Introduction：Basic information about CAS 5399-30-4|1-Phenyl-2-thiocyanatoethanone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-Phenyl-2-thiocyanatoethanone |
|---|
| CAS Number | 5399-30-4 | Molecular Weight | 177.22300 |
|---|
| Density | 1.223 g/cm3 | Boiling Point | 331.5ºC at 760 mmHg |
|---|
| Molecular Formula | C9H7NOS | Melting Point | 74.1-74.6°C (lit.) |
|---|
| MSDS | / | Flash Point | 154.3ºC |
|---|
Names
| Name | phenacyl thiocyanate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.223 g/cm3 |
|---|
| Boiling Point | 331.5ºC at 760 mmHg |
|---|
| Melting Point | 74.1-74.6°C (lit.) |
|---|
| Molecular Formula | C9H7NOS |
|---|
| Molecular Weight | 177.22300 |
|---|
| Flash Point | 154.3ºC |
|---|
| Exact Mass | 177.02500 |
|---|
| PSA | 66.16000 |
|---|
| LogP | 2.08358 |
|---|
| InChIKey | DLLVIJACDVJDIP-UHFFFAOYSA-N |
|---|
| SMILES | N#CSCC(=O)c1ccccc1 |
|---|
Safety Information
| Hazard Codes | Xi |
|---|
| Risk Phrases | 20/21/22-36/37/38 |
|---|
| Safety Phrases | 26-36/37/39 |
|---|
| HS Code | 2930909090 |
|---|
Customs
| HS Code | 2930909090 |
|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
|---|
Synonyms
| 2-oxo-2-phenylethynyl thiocyanate |
| 1-phenyl-2-thiocyanatoethanone |
| 2-oxo-2-phenylethyl thiocyanate |
| (2-oxo-2-phenylethyl)thiocarbonitrile |
| 2-(cyanosulfanyl)-1-phenylethan-1-one |
