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| Chemical manufacturer | ||||
| Name | 3-(Chloroacetyl)benzonitrile |
|---|---|
| Synonyms | 3-(2-chloroacetyl)benzonitrile |
| Molecular Structure |  |
| Molecular Formula | C9H6ClNO |
| Molecular Weight | 179.60 |
| CAS Registry Number | 76597-77-8 |
| SMILES | N#Cc1cccc(c1)C(=O)CCl |
| InChI | 1S/C9H6ClNO/c10-5-9(12)8-3-1-2-7(4-8)6-11/h1-4H,5H2 |
| InChIKey | SIJGQCMRBQTUBC-UHFFFAOYSA-N |
| Density | 1.269g/cm3 (Cal.) |
|---|---|
| Boiling point | 314.454°C at 760 mmHg (Cal.) |
| Flash point | 143.977°C (Cal.) |
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