Introduction：Basic information about CAS 3695-93-0|Benzeneacetonitrile,4-chloro-a-(phenylmethylene)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Benzeneacetonitrile,4-chloro-a-(phenylmethylene)- |
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| CAS Number | 3695-93-0 | Molecular Weight | 239.70000 |
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| Density | 1.211 g/cm3 | Boiling Point | 369ºC at 760 mmHg |
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| Molecular Formula | C15H10ClN | Melting Point | 113-117ºC(lit.) |
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| MSDS | / | Flash Point | 150.7ºC |
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Names
| Name | (E)-α-(4-CHLOROPHENYL)CINNAMONITRILE |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.211 g/cm3 |
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| Boiling Point | 369ºC at 760 mmHg |
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| Melting Point | 113-117ºC(lit.) |
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| Molecular Formula | C15H10ClN |
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| Molecular Weight | 239.70000 |
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| Flash Point | 150.7ºC |
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| Exact Mass | 239.05000 |
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| PSA | 23.79000 |
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| LogP | 4.40418 |
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| Index of Refraction | 1.645 |
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| InChIKey | JJGLLZWUWIKTAG-GXDHUFHOSA-N |
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| SMILES | N#CC(=Cc1ccccc1)c1ccc(Cl)cc1 |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- AT5710000
- CHEMICAL NAME :
- Acrylonitrile, 2-(p-chlorophenyl)-3-phenyl-
- CAS REGISTRY NUMBER :
- 3695-93-0
- BEILSTEIN REFERENCE NO. :
- 2331786
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C15-H10-Cl-N
- MOLECULAR WEIGHT :
- 239.71
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 800 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- BCPCA6 Biochemical Pharmacology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.1- 1958- Volume(issue)/page/year: 14,1325,1965
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Safety Information
| Hazard Codes | Xn: Harmful; |
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| Risk Phrases | R41 |
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| Safety Phrases | 22-26-36/37/39-45 |
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Synonyms
