3-(4-Chlorobenzoyl)-4,4-bis(methylsulfanyl)-3-butenenitrile
3-(4-chlorobenzoyl)-4,4-bis(methylsulfanyl)but-3-enenitrile
Also Known As: KS-00003C6G|3-(4-chlorobenzoyl)-4,4-bis(methylsulfanyl)-3-butenenitrile|3-(4-chlorobenzoyl)-4,4-bis(methylsulfanyl)but-3-enenitrile|6X-0955|SR-01000309318-1|3-(4-Chlorobenzoyl)-4,4-bis(methylthio)but-3-enenitrile
CAS: 77147-93-4
| Molecular Formula | C13H12ClNOS2 |
|---|---|
| Molecular Weight | 297.00488 g/mol |
| LogP | 4.37398 |
| Topological Polar Surface Area | 40.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 297.00488 |
| Monoisotopic Mass | 297.00488 |
| Heavy Atoms | 18 |
| Complexity | 496.71768 |
Chemical Identifiers
| CAS Number | 77147-93-4 |
|---|---|
| SMILES | CSC(=C(CC#N)C(=O)C1=CC=C(C=C1)Cl)SC |
Product Overview
3-(4-Chlorobenzoyl)-4,4-bis(methylsulfanyl)-3-butenenitrile (CAS 77147-93-4), with molecular formula C13H12ClNOS2 and molecular weight 297.00488 g/mol. IUPAC: 3-(4-chlorobenzoyl)-4,4-bis(methylsulfanyl)but-3-enenitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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3-(4-Chlorobenzoyl)-4,4-bis(methylsulfanyl)-3-butenenitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
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