3-Acetylbenzonitrile
Product Description
| Product | 3-Acetylbenzonitrile |
| CAS | 6136-68-1 |
| Formula | C9H7NO |
| Synonym | m-Cyanoacetophenone, 3'-Cyanoacetophenone, Benzonitrile, 3-acetyl-, 3-CN-C6H4-COCH3, M-CYANOACETOPHENONE, M-ACETYLBENZONITRILE, 3'-CYANOACETOPHENONE, 3-CYANOACETOPHENONE, 3-ACETYLBENZONITRILE, Benzonitrile, 3-acetyl-, 3-Acetylbenzonitrile97%, 3-acetylbenzonitrile,98% |
Typical Product Specifications
| EINECS | 228-110-6 |
| SMILES | CC(=O)c1cc(C#N)ccc1 |
| InChI | 1S/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H3 |
| log P (octanol-water) | 1.16 |
| Henry's Law Constant | 9.48E-08 atm-m3/mole |
| Vapor Pressure | 6.42E-03 mm Hg |
| Atmospheric OH Rate Constant | 4.16E-13 cm3/molecule-sec |
| Melting Point | 98-100 ° C |
| Water solubility | 4420 mg/L |
| Boiling Point | 120 °C (5 mmHg) |
| BRN Number | 2079629 |
| Flash Point | 120°C/5mm |
| Melting Point | 98-100 °C |
| Water solubility | Insoluble in water. |
| Molecular weight | 145.16 |
| Class | Specialty Chemicals |
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