Introduction：Basic information about CAS 610-39-9|3,4-dinitrotoluene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,4-dinitrotoluene |
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| CAS Number | 610-39-9 | Molecular Weight | 182.13400 |
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| Density | 1.407g/cm3 | Boiling Point | 350.8ºC at 760 mmHg |
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| Molecular Formula | C7H6N2O4 | Melting Point | 54-57 °C(lit.) |
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| MSDS | / | Flash Point | >230 °F |
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Names
| Name | 4-methyl-1,2-dinitrobenzene |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.407g/cm3 |
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| Boiling Point | 350.8ºC at 760 mmHg |
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| Melting Point | 54-57 °C(lit.) |
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| Molecular Formula | C7H6N2O4 |
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| Molecular Weight | 182.13400 |
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| Flash Point | >230 °F |
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| Exact Mass | 182.03300 |
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| PSA | 91.64000 |
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| LogP | 2.85780 |
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| Index of Refraction | 1.598 |
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| InChIKey | INYDMNPNDHRJQJ-UHFFFAOYSA-N |
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| SMILES | Cc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- XT2100000
- CHEMICAL NAME :
- Toluene, 3,4-dinitro-
- CAS REGISTRY NUMBER :
- 610-39-9
- LAST UPDATED :
- 199710
- DATA ITEMS CITED :
- 12
- MOLECULAR FORMULA :
- C7-H6-N2-O4
- MOLECULAR WEIGHT :
- 182.15
- WISWESSER LINE NOTATION :
- WNR D1 FNW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 807 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 747 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity)
MUTATION DATA - TYPE OF TEST :
- DNA damage
- TEST SYSTEM :
- Rodent - rat Liver
- REFERENCE :
- SinJF# Personal Communication from J.F. Sina, Merck Institute for Therapeutic Research, West Point, PA 19486, Oct. 26, 1982 Volume(issue)/page/year: 26OCT1982 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH RECOMMENDED EXPOSURE LEVEL (REL) : NIOSH REL TO 3,4-DINITROTOLUENE-air:10H CA TWA 1.5 mg/m3 (Sk) REFERENCE : NIOSH* National Institute for Occupational Safety and Health, U.S. Dept. of Health, Education, and Welfare, Reports and Memoranda. Volume(issue)/page/year: DHHS #92-100,1992
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Safety Information
| Hazard Codes | T,N |
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| Risk Phrases | 45-23/24/25-48/22-51/53-62-68 |
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| Safety Phrases | S53-S45-S61 |
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| RIDADR | UN 3454 6.1/PG 2 |
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| WGK Germany | 3 |
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| RTECS | XT2100000 |
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| Packaging Group | II |
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| Hazard Class | 6.1 |
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| HS Code | 2904203000 |
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Customs
| HS Code | 2904203000 |
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| Summary | 2904203000 4-methyl-1,2-dinitrobenzene。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tarrif:5.5%。general tariff:20.0% |
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Synonyms
| Toluene,3,4-dinitro |
| 3,4-Dinitro-toluol |
| MFCD00007270 |
| 1-methyl-3,4-dinitrobenzene |
| EINECS 210-222-1 |
| 3,4-dinitrotoluene |
| Benzene,4-methyl-1,2-dinitro |
| 3,4-DNT |
