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| Name |
3,4,5-Trinitrotoluene |
EINECS | N/A |
| CAS No. | 603-15-6 | Density | 1.608g/cm3 |
| PSA | 137.46000 | LogP | 3.28920 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C7H5 N3 O6 | Boiling Point | 448.4°C at 760 mmHg |
| Molecular Weight | 227.133 | Flash Point | 242.6°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Mutation data reported. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Toluene,3,4,5-trinitro- (8CI); 3,4,5-Trinitrotoluene |
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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