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2-propenal (C3H4O)

Compound Descriptions:

Structure Drawing
Formula:C3H4O
Molecular Weight:56.063 g/mol
Name(s):2-propenal
prop-2-enal
Acrylaldehyde
Acrolein
2-Propen-1-one
Acrylic aldehyde
Allyl aldehyde
Aqualin
Magnacide B
Magnacide H
NSC 8819
Prop-2-en-1-al
acroleine
trans-Acrolein
Acquinite
Aqualine
Biocide
Crolean
Ethylene aldehyde
Propylene aldehyde
Slimicide
Acraldehyde
CAS-RN:107-02-8, 25314-61-8
EINECS:203-453-4 EINECS
Classification:no charge; aldehyde; 1fragment

European Regulations

4 matching entries in european regulations: Hazard, GHS, REACH, ECHA-pre

Derivatives / Analogues

Derivativehydrate salt: Acrolein-2-Natriumbisulfit-tetrahydrat 
Analogueother chalcogen: 2-Propenethial 

Landolt-Börnstein Citations:

Acoustical and Optical Properties

 Molecular Acoustics: Vol. II/5 2.1.2, p.19II/5
 Molecular Acoustics: Vol. II/5 3.2.2, p.160II/5
 Molecular Acoustics: Vol. II/5 3.2.7, p.182II/5
 Optical Constants: Refractive Indices: Vol. III/38b 2.1:1298III/38B

Magnetic Properties

 Magnetic anisotropy data: Vol. II/27c 11.3:102II/27C

Mechanical Properties

 C-H-O compounds: C3 (part 2): Vol. IV/1a 1.4.3:1735, p.233 (mix)IV/1a

Spectroscopic Methods

 Nuclear Magnetic Resonance (NMR) Data - 17O: Vol. III/35e 2.2.1:54III/35E

Structure and Molecular Constants

 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/4 2.5:99II/4
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/4 2.6:150II/4
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/4 2.8:26II/4
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/6 2.5:136II/6
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/6 2.9.3:27II/6
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/14a 2.5.2:318II/14a
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/14a 2.9.3.2:26II/14a
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/19b 2.5.2:266II/19b
 Molecular Constants Mostly From Microwave, Molecular Beam, Electro Spin Resonance and Sub-Doppler Laser Spectroscopy: Vol. II/19c 2.6.4.2:116II/19c
 Structure Data of Free Polyatomic Molecules: Vol. II/25c 3:1160II/25C
 Theoretical Structures of Molecules: Vol. II/22a 2:310II/22a

Thermodynamic Properties

 Thermodynamic Properties of Organic Compounds and Their Mixtures: Vol. IV/8i 3.2:141, p.85IV/8I
 Vapor Pressure of Chemicals: Vol. IV/20b 2.2:344IV/20B
 Aldehydes + Alcohols: Vapor-Liquid Equilibrium - Propenal C3H4O + C4H10O Butan-1-ol: Vol. IV/13A1 2161 (mix)IV/13A1
 Aldehydes + Alcohols: Vapor-Liquid Equilibrium - Propenal C3H4O + C5H12O Pentan-1-ol: Vol. IV/13A1 2162 (mix)IV/13A1
 Aldehydes + Alcohols: Vapor-Liquid Equilibrium - Propenal C3H4O + C3H8O Propan-2-ol: Vol. IV/13A1 2163 (mix)IV/13A1
 Aldehydes + Alcohols: Vapor-Liquid Equilibrium - Propenal C3H4O + C3H8O Propan-2-ol: Vol. IV/13A1 2164 (mix)IV/13A1

References

II/14a
Short: II/14a
Title: Molecular Constants: Diamagnetic Molecules
Author: Demaison, J.; Dubrulle, A.; Hüttner, W.; Tiemann, E.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: II/14a
Page: 1-788
Year: 1982
Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy
ISBN: 3-540-11365-7
ISBN: 978-3-540-11365-2
Internet Resource: DOI:10.1007/b19966
RefComment: 196 figs., XI
II/19b
Short: II/19b
Title: Molecular Constants: Rotational, Centrifugal Distortion and Related Constants of Diamagnetic Asymmetric Top Molecules
Author: Demaison, J.; Hüttner, W.; Vogt, J.; Wlodarczak, G.
Editor: Hüttner, W.
Source: Landolt-Börnstein, New Series
Volume: II/19b
Year: 1992
Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy
ISBN: 3-540-54578-6
ISBN: 978-3-540-54578-1
Internet Resource: DOI:10.1007/b44334
RefComment: XI, 488 pages.
Abstract: Volume II/19 Molecular Constants mostly from Microwave, Molecular Beam and Sub-Doppler Laser Spectroscopy is a supplement to the earlier volumes II/4, II/6, and II/14. The slight change in the title reflects current trends in the applications of spectroscopic methods. Together, the four volumes collect all the critically evaluated data published up to 1989/90 on constants of free molecules obtained by classical and modern spectroscopy. Volume II/19 is divided into four parts to record the growing number of investigations, especially in the microwave and millimeter wave regions, where modern techniques like Fourier Transform Microwave Spectroscopy have made new objects of interest such as molecular complexes and clusters accessible to study. Subvolume II/19b contains corresponding data on diamagnetic asymmetric top molecules.
II/19c
Short: II/19c
Title: Molecular Constants: Dipole Moments, Quadrupole Coupling Constants, Hindered Rotation and Magnetic Constants of Diamagnetic Molecules
Author: Demaison, J.; Hüttner, W.; Tiemann, E.; Vogt, J.; Wlodarczak, G.
Editor: Hüttner, W.
Source: Landolt-Börnstein, New Series
Volume: II/19c
Year: 1992
Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy
ISBN: 3-540-54893-9
ISBN: 978-3-540-54893-5
Internet Resource: DOI:10.1007/b44435
RefComment: 8 figs., XI, 295 pages.
Abstract: Volume II/19 Molecular Constants mostly from Microwave, Molecular Beam and Sub-Doppler Laser Spectroscopy is a supplement to the earlier volumes II/4, II/6, and II/14. The slight change in the title reflects current trends in the applications of spectroscopic methods. Together, the four volumes collect all the critically evaluated data published up to 1989/90 on constants of free molecules obtained by classical and modern spectroscopy. Volume II/19 is divided into four parts to record the growing number of investigations, especially in the microwave and millimeter wave regions, where modern techniques like Fourier Transform Microwave Spectroscopy have made new objects of interest such as molecular complexes and clusters accessible to study. Subvolume II/19c contains tables for diamagnetic molecules giving further spectroscopic parameters: quadrupole coupling constants, potential barriers, and data from Stark and Zeeman effect measurements.
II/22a
Short: II/22a
Title: Theoretical Structures of Molecules: Multiple Bonds
Author: Hampel, F.
Editor: von Ragué Schleyer, P.
Source: Landolt-Börnstein, New Series
Volume: II/22a
Year: 1993
ISBN: 3-540-56331-8
ISBN: 978-3-540-56331-0
Internet Resource: DOI:10.1007/b48045
RefComment: VIII, 193 pages. Hardcover
Abstract: Volume II/22 presents computed geometries. Quantum chemical computations provide an excellent alternative to experimental methods for the determination of accurate structures of polyatomic molecules. The objective is not to duplicate, but rather to complement the existing literature. An advantage of computational chemistry over experimental methods is the possi-bility to obtain reliable geometries of molecules, even of important systems, which are difficult to synthesize, isolate, and to study experimentally.
II/25C
Short: II/25C
Title: Structure Data Of Free Polyatomic Molecules: Molecules containing Three or Four Carbon Atoms
Author: Graner, G.; Hirota, E.; Iijima, T.; Kuchitsu, K.; Ramsay, D.A.; Vogt, J.; Vogt, N.
Editor: Kuchitsu, K.
Source: Landolt-Börnstein, New Series
Volume: II/25C
Year: 2001
Keyword: Free Polyatomic Molecules; Carbon Atoms; Molecules
ISBN: 3-540-66774-1
ISBN: 978-3-540-66774-2
Internet Resource: DOI:10.1007/b71431
RefComment: VIII, 481 pages. Hardcover
Abstract: This volume contains data on the geometric parameters (internuclear distances, bond angles, dihedral angles of internal rotation etc.) of free polyatomic molecules including free radicals and molecular ions. This survey on structure data is made of four subvolume, each containing the geometric parameters determined in the gas phase either by an analysis of the rotational constants (and sometimes the vibrational constants) obtained from microwave, infrared, Raman, electronic and photoelectron spectroscopy or by an analysis of electron diffraction intensities. Most of the structures listed in the tables are for molecules in the electronic ground state, but structures for electronically excited states have also been included as far as they are available. In this third subvolume, the structure of molecules containing three for four carbon atoms are listed.
II/27C
Short: II/27C
Title: Diamagnetic Susceptibility and Magnetic Anisotropy of Organic Compounds
Author: Kumar, Mahendra; Gupta, Rajni
Editor: Gupta, Radha Raman
Source: Landolt-Börnstein, New Series
Volume: II/27C
Year: 2008
Keyword: diamagnetic susceptibility; magnetic anisotropy; organic compounds
ISBN: 978-3-540-44734-4 (print)
ISBN: 978-3-540-44736-8 (online)
Internet Resource: doi:10.1007/978-3-540-44736-8
RefComment: VIII, 204 p., Hardcover
RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science
RefComment: Supplement and Revised Editon to II/16
Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds (Part 1); Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds (Part 2). The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005.
II/4
Short: II/4
Title: Molecular Constants from Microwave Spectroscopy
Author: Starck, B.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: II/4
Page: 1-225
Year: 1967
Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy
ISBN: 3-540-03896-5
ISBN: 978-3-540-03896-2
Internet Resource: DOI:10.1007/b19949
RefComment: 67 figs., X
II/5
Short: II/5
Title: Molecular Acoustics
Author: Schaaffs, W.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: II/5
Year: 1967
ISBN: 3-540-03897-3
ISBN: 978-3-540-03897-9
Internet Resource: DOI:10.1007/b19950
RefComment: 321 figs., XII, 286 pages, Hardcover
II/6
Short: II/6
Title: Molecular Constants from Microwave, Molecular Beam, and Electron Spin Resonance Spectroscopy
Author: Demaison, J.; Hüttner, W.; Starck, B.; Buck, I.; Tischer, R.; Winnewisser, M.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: II/6
Year: 1974
Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy
ISBN: 3-540-05977-6
ISBN: 978-3-540-05977-6
Internet Resource: DOI:10.1007/b19951
RefComment: 153 figs., XIII, 688 pages
III/35E
Short: III/35E
Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17
Author: Duddeck, H.; Toth, G.; Simon, A.
Editor: Gupta, R.R.; Lechner, M.D.
Source: Landolt-Börnstein, New Series
Volume: III/35E
Year: 2002
Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ
ISBN: 3-540-42501-2
ISBN: 978-3-540-42501-4
Internet Resource: DOI:10.1007/b92953
RefComment: VII, 230 pages. With CD-ROM., Hardcover
Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
III/38B
Short: III/38B
Title: Refractive Indices of Organic Liquids
Author: Wohlfarth, Ch.; Wohlfarth, B.
Editor: Lechner, M.D.
Source: Landolt-Börnstein, New Series
Volume: III/38B
Year: 1996
Keyword: organic compounds; refractive index; liquids
ISBN: 3-540-60596-7
ISBN: 978-3-540-60596-6
Internet Resource: DOI:10.1007/b85533
RefComment: VII, 4210 pages, Hardcover
Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.
IV/13A1
Short: IV/13A1
Title: Vapor-Liquid Equilibrium in Mixtures and Solutions. Binary Liquid Systems of Nonelectrolytes. Part 1
Author: Wichterle, I.; Linek, J.; Wagner, Z.; Fontaine, J.-C.; Sosnkowska-Kehiaian, K.; Kehiaian, H. V.
Editor: Kehiaian, H.V.
Source: Landolt-Börnstein, New Series
Volume: IV/13A1
Year: 2007
Keyword: Activity coefficients; Excess Gibbs energy; Mixtures; Nonelectrolytes; Solutions; Vapor-liquid equilibria
ISBN: 978-3-540-49314-3 (Print)
ISBN: 978-3-540-49315-0 (Online)
Internet Resource: doi: 10.1007/978-3-540-49315-0
RefComment: X, 571 p. 820 illus. With CD-ROM., Hardcover
RefComment: Written for: Scientists and engineers in the field of physical chemistry, organic chemistry, inorganic chemistry, biochemistry, applied chemistry
Abstract: This volume is a compilation of vapor–liquid equilibrium data on subcritical binary single-phase or two-phase liquid–liquid systems. All the components are well-defined pure substances, which are organic or inorganic nonelectrolytes, including low-melting ionic liquids and water. The present database contains numerical data for 3316 systems. The book reproduces in tables and graphs the numerical values for only 802 binary mixtures, chosen to be representative of all the compound classes and property types. The full set of data is given on the CD–ROM accompanying the book. Most data files contain experimental data compiled from the original literature published from 1929 to mid 2006. The CD-ROM displays all these data in PDF format and in fully documented computer readable standard electronic files (SELF and ELDATA). The ELBT-program allows the fast search of data according to property type, chemical system, author(s), source and year of publication. It also includes the bibliographical database of ELDATA, EVLM’2006, giving 13471 references from 1888 through mid 2006 to experimental vapor–liquid equilibrium in mixtures and solution.
IV/1a
Short: IV/1a
Title: Densities of Liquid Systems: Nonaqueous Systems and Ternary Aqueous Systems
Author: Lacmann, R.; Synowietz, C.
Editor: Schäfer, Kl.
Source: Landolt-Börnstein, New Series
Volume: IV/1a
Year: 1974
ISBN: 3-540-06269-6
ISBN: 978-3-540-06269-1
Internet Resource: DOI:10.1007/b20003
RefComment: X, 716 pages. Hardcover
Abstract: Volume IV/1 contains information on the densities of liquid systems. It may be considered as a supplement to volume II/1 of the 6th Edition, which contains only a few data on nonaqueous systems. Data are not listed for all systems but primarily for those of greater interest where data for a larger range of concentrations were available.
IV/20B
Short: IV/20B
Title: Vapor Pressure and Antoine Coefficients for Oxygen Containing Organic Compounds
Author: Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.; Hall, K.R.
Editor: Hall, K.R.
Source: Landolt-Börnstein, New Series
Volume: IV/20B
Year: 2000
Keyword: organic compounds; vapor pressure
ISBN: 3-540-64968-9
ISBN: 978-3-540-64968-7
Internet Resource: DOI:10.1007/b71424
RefComment: VII, 320 pages.
IV/8I
Short: IV/8I
Title: Densities of Phenols, Aldehydes, Ketones, Carboxylic Acids, Amines, Nitriles, and Nitrohydrocarbons
Author: Frenkel, M.; Hong, X.; Dong, Q.; Yan, X.; Chirico, R.D.
Editor: Frenkel, M.; Marsh, K.N.
Source: Landolt-Börnstein, New Series
Volume: IV/8I
Year: 2002
Keyword: Thermodynamics; Thermodynamik
ISBN: 978-3-540-42883-1
ISBN: 3-540-42883-6
Internet Resource: DOI:10.1007/b76771
RefComment: XI, 470 p., Hardcover
RefComment: Written for Scientists and engineers in the fields of Physics, Chemistry and Physical Chemistry
Abstract: Critically evaluated experimental data covering the densities of organic compounds are essential for both scientific and industrial applications. Knowledge of densities is important in many areas, including custody transfer of materials, product specification, development of various predictive methods, and for characterizing compounds and estimating their purity.
EINECS
Short: EINECS
Title: EINECS (European Inventory of Existing Commercial Chemical Substances)
Source: Official Journal of the European Communities
Volume: C 146 A (15.06.1990)
Page: 1
Year: 1990
Publish_Date: 1990/06/15

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