-
Name
3,4,5-TRINITROTOLUENE
- EINECS
- CAS No. 603-15-6
- Density 1.608g/cm3
- Solubility
- Melting Point
- Formula C7H5 N3 O6
- Boiling Point 448.4°C at 760 mmHg
- Molecular Weight 227.133
- Flash Point 242.6°C
- Transport Information
- Appearance
- Safety Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Toluene,3,4,5-trinitro- (8CI); 3,4,5-Trinitrotoluene
- PSA 137.46000
- LogP 3.28920
3,4,5-Trinitrotoluene Chemical Properties
Empirical Formula of 3,4,5-Trinitrotoluene (CAS NO.603-15-6): C7H5N3O6
Molecular Weight: 227.1311 g/mol
Index of Refraction: 1.637
Density: 1.608 g/cm3
Flash Point: 242.6 °C
Enthalpy of Vaporization: 67.97 kJ/mol
Boiling Point: 448.4 °C at 760 mmHg
Vapour Pressure: 8.23E-08 mmHg at 25 °C
Structure of 3,4,5-Trinitrotoluene (CAS NO.603-15-6):
IUPAC Name: 5-Methyl-1,2,3-trinitrobenzene
Canonical SMILES: CC1=CC(=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChI: InChI=1S/C7H5N3O6/c1-4-2-5(8(11)12)7(10(15)16)6(3-4)9(13)14/h2-3H,1H3
InChIKey: MRVQHWLGKAVHRB-UHFFFAOYSA-N
3,4,5-Trinitrotoluene Toxicity Data With Reference
| 1. | mic-sat 500 ng/plate | ENMUDM Environmental Mutagenesis. 4 (1982),163. |
3,4,5-Trinitrotoluene Safety Profile
Mutation data reported. When heated to decomposition 3,4,5-Trinitrotoluene (CAS NO.603-15-6) emits toxic vapors of NOx.
3,4,5-Trinitrotoluene Specification
3,4,5-Trinitrotoluene , its cas register number is 603-15-6. It also can be called Benzene, 5-methyl-1,2,3-trinitro- (9CI) ; Benzene, 5-methyl-1,2,3-trinitro- ; and Toluene, 3,4,5-trinitro- .
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