Introduction：Basic information about CAS 603-15-6|5-methyl-1,2,3-trinitrobenzene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5-methyl-1,2,3-trinitrobenzene |
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| CAS Number | 603-15-6 | Molecular Weight | 227.13100 |
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| Density | 1.608g/cm3 | Boiling Point | 448.4ºC at 760 mmHg |
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| Molecular Formula | C7H5N3O6 | Melting Point | / |
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| MSDS | / | Flash Point | 242.6ºC |
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Names
| Name | 5-methyl-1,2,3-trinitrobenzene |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.608g/cm3 |
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| Boiling Point | 448.4ºC at 760 mmHg |
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| Molecular Formula | C7H5N3O6 |
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| Molecular Weight | 227.13100 |
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| Flash Point | 242.6ºC |
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| Exact Mass | 227.01800 |
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| PSA | 137.46000 |
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| LogP | 3.28920 |
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| Index of Refraction | 1.637 |
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| InChIKey | MRVQHWLGKAVHRB-UHFFFAOYSA-N |
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| SMILES | Cc1cc([N+](=O)[O-])c([N+](=O)[O-])c([N+](=O)[O-])c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XU0183000
- CHEMICAL NAME :
- Toluene, 3,4,5-trinitro-
- CAS REGISTRY NUMBER :
- 603-15-6
- BEILSTEIN REFERENCE NO. :
- 2056922
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H5-N3-O6
- MOLECULAR WEIGHT :
- 227.15
- WISWESSER LINE NOTATION :
- WNR E1 BNW CNW
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA - TYPE OF TEST :
- Mutation in microorganisms
- TEST SYSTEM :
- Bacteria - Salmonella typhimurium
- DOSE/DURATION :
- 500 ng/plate
- REFERENCE :
- ENMUDM Environmental Mutagenesis. (New York, NY) V.1-9, 1979-87. For publisher information, see EMMUEG. Volume(issue)/page/year: 4,163,1982
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Synonyms
| Benzene,5-methyl-1,2,3-trinitro |
| Toluene,3,4,5-trinitro |
| 3,4,5-Trinitrotoluene |
| 3,4,5-Trinitrotoluol |
