Introduction：Basic information about CAS 6268-00-4|Benzenebutanenitrile, g-oxo-a-phenyl-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzenebutanenitrile, g-oxo-a-phenyl- |
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| CAS Number | 6268-00-4 | Molecular Weight | 235.28100 |
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| Density | 1.126g/cm3 | Boiling Point | 424.7ºC at 760 mmHg |
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| Molecular Formula | C16H13NO | Melting Point | / |
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| MSDS | / | Flash Point | 210.7ºC |
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Names
| Name | 4-oxo-2,4-diphenylbutanenitrile |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.126g/cm3 |
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| Boiling Point | 424.7ºC at 760 mmHg |
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| Molecular Formula | C16H13NO |
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| Molecular Weight | 235.28100 |
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| Flash Point | 210.7ºC |
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| Exact Mass | 235.10000 |
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| PSA | 40.86000 |
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| LogP | 3.56678 |
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| Index of Refraction | 1.584 |
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| InChIKey | JRWUFQJVJGKCCT-UHFFFAOYSA-N |
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| SMILES | N#CC(CC(=O)c1ccccc1)c1ccccc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- CY9040892
- CHEMICAL NAME :
- Benzenebutanenitrile, gamma-oxo-alpha-phenyl-
- CAS REGISTRY NUMBER :
- 6268-00-4
- BEILSTEIN REFERENCE NO. :
- 0649013
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C16-H13-N-O
- MOLECULAR WEIGHT :
- 235.30
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD - Lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 6,57,1954
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Synonyms
| 4-oxo-2,4-diphenylbutyronitrile |
| 4-diphenylbutanenitrile |
| 4-Oxo-2,4-diphenyl-butyronitril |
| 3-benzoyl-2-phenylpropionitrile |
| EINECS 228-440-0 |
| 2,4-diphenyl-4-butyronitrilone |
