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s-trinitrobenzene (C6H3N3O6)

Compound Descriptions:

Structure Drawing
Formula:C6H3N3O6
Molecular Weight:213.105 g/mol
Name(s):s-trinitrobenzene
benzene, 1,3,5-trinitro-
1,3,5-trinitrobenzene
1,3,5-trinitro-benzene
1,3,5-Trinitrobenzol
s-Trinitrobenzol
2,4,6-Trinitrobenzene
sym-Trinitrobenzene
TNB
TNB (nitro compound)
1,3,5-trinitobenzene
syn-Trinitrobenzene
Benzene, trinitro- (wet)
CAS-RN:99-35-4
EINECS:202-752-7 EINECS
Classification:no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment

European Regulations

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

Landolt-Börnstein Citations:

Crystallography, Structure and Morphology

 Structure Data of Organic Crystals: Vol. III/5a 2:6-3-17, p.249III/5a
 C6 (709 - 1091): C6Ce - C6H5 (709 - 773): Vol. III/10A 2:738, p.133III/10a

Magnetic Properties

 Diamagnetic Susceptibility: Vol. II/27b 7.1.6:524II/27B
 Magnetic anisotropy data: Vol. II/27c 11.3:199II/27C

Mechanical Properties

Spectroscopic Methods

Structure and Molecular Constants

Thermodynamic Properties

 Data in diagrams and tables: Ternary systems: Vol. IV/4 7.2.4.2:1554, p.338 (mix)IV/4
 Thermodynamic Properties of Organic Compounds and Their Mixtures: Vol. IV/8a 3.5.3, p.124IV/8A
 Vapor Pressure of Chemicals: Vol. IV/20b 2.2:874IV/20B
 Vapor Pressure of Chemicals: Vol. IV/20c 2.5:749IV/20C

References

II/25D
Short: II/25D
Title: Structure Data of Free Polyatomic Molecules: Molecules Containing Five or More 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/25D
Year: 2003
Keyword: Free Polyatomic Molecules; Carbon Atoms; Molecules
ISBN: 3-540-42860-7
ISBN: 978-3-540-42860-2
Internet Resource: DOI:10.1007/b75952
RefComment: VIII, 569 pages. Hardcover
RefComment: Written for scientists and researchers in the fields of chemistry and physics
Abstract: This fourth subvolume presents 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. The survey on structure data consists of four subvolumes, 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 fourth subvolume, the structure of molecules containing five to sixty carbon atoms is listed.
II/27B
Short: II/27B
Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes
Author: Kumar, M.; Gupta, R.
Editor: Gupta, Radha Raman
Source: Landolt-Börnstein, New Series
Volume: II/27B
Year: 2008
Keyword: diamagnetic susceptibility; organic compounds
ISBN: 978-3-540-44359-9 (print)
ISBN: 978-3-540-45860-9 (online)
Internet Resource: doi:10.1007/978-3-540-45860-9
RefComment: VIII, 503 p. With CD-ROM., 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, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
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.
III/10a
Short: III/10a
Title: Structure Data of Organic Crystals: C ... C 15
Author: Schudt-Weitz, G.; Strell, I.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: III/10a
Year: 1985
ISBN: 3-540-07834-7
ISBN: 978-3-540-07834-0
Internet Resource: DOI:10.1007/b19984
RefComment: XXII, 634 pages. Hardcover
Abstract: The volume includes an alphabetical index of all substances and a separate "ring index" with all cyclic compounds.
III/20a
Short: III/20a
Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cl
Author: Chihara, H.; Nakamura, N.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: III/20a
Year: 1988
Keyword: NQR
ISBN: 3-540-18161-X
ISBN: 978-3-540-18161-3
Internet Resource: DOI:10.1007/b31153
RefComment: IX,677 pages. Hardcover
Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.
III/31a
Short: III/31a
Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cu
Author: Chihara, H.; Nakamura, N.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: III/31a
Year: 1993
Keyword: NQR
ISBN: 3-540-55146-8
ISBN: 978-3-540-55146-1
Internet Resource: DOI:10.1007/b43999
RefComment: VIII, 437 pages. Hardcover
Abstract: Volume III/31 continues the compilation of nuclear quadrupole resonance spectroscopy data of solid substances which started in with volume III/20 in 1987 covering the literature from the beginning of nuclear quadrupole resonance spectroscopy in 1951 to 1982 and containing the data for 8000 substances in the solid state, distributed among three subvolumes III/20 a, b, and c. Volume III/31 covers the literature published in the period from the end of 1982 through the end of 1989. Included are the data for substances studied for the first time, as well as data for substances already present in the previous volume III/20 if the data published there could be completed or improved by new studies. In total there are 2500 substances in volume III/31, showing the scope and significance of nuclear quadrupole resonance spectroscopy up to recent times.
III/35B
Short: III/35B
Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15
Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S.
Editor: Gupta, R.R.; Lechner, M.D.
Source: Landolt-Börnstein, New Series
Volume: III/35B
Year: 1998
ISBN: 3-540-63275-1
ISBN: 978-3-540-63275-7
Internet Resource: DOI:10.1007/b55685
RefComment: VII, 242 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), and carbon-13 (subvol. D) 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 CO-ROM's.
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/5a
Short: III/5a
Title: Structure Data of Organic Crystals: C ... C 13
Author: Schudt, E.; Weitz, G.
Editor: Hellwege, K.-H.; Hellwege, A.M.
Source: Landolt-Börnstein, New Series
Volume: III/5a
Year: 1971
ISBN: 3-540-05177-5
ISBN: 978-3-540-05177-0
Internet Resource: DOI:10.1007/b19970
RefComment: XXI, 736 pages, and VII, 890 pages. Hardcover
Abstract: Volume III/5 offers a compitation as complete as possible of the space groups and lattice con-stants of all crystals which have been studied by means of X-rays, neutron and electron diffraction.
IV/18A
Short: IV/18A
Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organometallic and Organononmetallic Liquids, Binary Liquid Mixtures
Author: Wohlfarth, Ch.; Wohlfarth, B.
Editor: Lechner, M.D.
Source: Landolt-Börnstein, New Series
Volume: IV/18A
Year: 2001
Keyword: organic compounds; viscosity; liquids; mixtures
ISBN: 3-540-64584-5
ISBN: 978-3-540-64584-9
Internet Resource: DOI:10.1007/b68239
RefComment: VII, 409 pages.
IV/18B
Short: IV/18B
Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organic Liquids
Author: Wohlfarth, Ch.; Wohlfarth, B.
Editor: Lechner, M.D.
Source: Landolt-Börnstein, New Series
Volume: IV/18B
Year: 2001
Keyword: organic compounds; viscosity; liquids; mixtures
Internet Resource: DOI:10.1007/b68240
RefComment: VII, 409 pages.
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/20C
Short: IV/20C
Title: Vapor Pressure and Antoine Coefficients for Nitrogen 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/20C
Year: 2001
Keyword: organic compounds; vapor pressure
ISBN: 3-540-41060-0
ISBN: 978-3-540-41060-7
Internet Resource: DOI:10.1007/b88812
RefComment: VII, 197 pages
IV/4
Short: IV/4
Title: High-Pressure Properties of Matter
Author: Beggerow, G.
Editor: Schäfer, Kl.
Source: Landolt-Börnstein, New Series
Volume: IV/4
Year: 1980
ISBN: 3-540-09370-2
ISBN: 978-3-540-09370-1
Internet Resource: DOI:10.1007/b90280
RefComment: 589 figs., VIII, 427 pages. Hardcover
Abstract: The main topics are pressure dependences of phase equilibria, compressibility, thermal and caloric properties, transport phenomena, static and magnetic properties, optical phenomena, kinetic phenomena, and systems in the neighbourhood and above the critical area.
IV/8A
Short: IV/8A
Title: Enthalpies of Fusion and Transition of Organic Compounds
Author: Zhang, Z.-Y.; Frenkel, M.; March, K.N.; Wilhoit, R.C.
Editor: Marsh, K.N.
Source: Landolt-Börnstein, New Series
Volume: IV/8A
Year: 1995
Keyword: organic compounds; enthaly of fusion; melting point; phase transition
ISBN: 3-540-58854-X
ISBN: 978-3-540-58854-2
Internet Resource: DOI:10.1007/b55145
RefComment: VIII, 588 pages.
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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