Introduction：Basic information about CAS 5913-06-4|3,5-Dinitrobenzil, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3,5-Dinitrobenzil |
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| CAS Number | 5913-06-4 | Molecular Weight | 300.22300 |
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| Density | 1.471g/cm3 | Boiling Point | 505ºC at 760 mmHg |
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| Molecular Formula | C14H8N2O6 | Melting Point | / |
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| MSDS | / | Flash Point | 253ºC |
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Names
| Name | 1,2-bis(3-nitrophenyl)ethane-1,2-dione |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.471g/cm3 |
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| Boiling Point | 505ºC at 760 mmHg |
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| Molecular Formula | C14H8N2O6 |
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| Molecular Weight | 300.22300 |
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| Flash Point | 253ºC |
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| Exact Mass | 300.03800 |
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| PSA | 125.78000 |
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| LogP | 3.61500 |
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| Index of Refraction | 1.648 |
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| InChIKey | SGKVXDKTNJHBCA-UHFFFAOYSA-N |
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| SMILES | O=C(C(=O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- DD1980000
- CHEMICAL NAME :
- Benzil, 3,5'-dinitro-
- CAS REGISTRY NUMBER :
- 5913-06-4
- BEILSTEIN REFERENCE NO. :
- 2003620
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C14-H8-N2-O6
- MOLECULAR WEIGHT :
- 300.24
- WISWESSER LINE NOTATION :
- WNR CYQVR CNW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 56 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#03284
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Synonyms
| bis(3-nitrophenyl)-ethanedione |
| Bis(m-nitrophenyl)ethanedione |
| 1,2-bis-(3-nitrophenyl)ethane-1,2-dione |
| 3,5'-Dinitrobenzil |
| 1,2-bis{3-nitrophenyl}-1,2-ethanedione |
| Ethanedione,bis(3-nitrophenyl) |
| 3,3'-dinitro-benzil |
| Benzil,3,5'-dinitro |
| di-meta-nitrobenzyl |
| 3,3'-dinitrobenzyl |
