Pentylthiocarbamic acid S-phenyl ester
S-phenyl N-pentylcarbamothioate
CAS: 18312-38-4
| Molecular Formula | C12H17NOS |
|---|---|
| Molecular Weight | 223.34 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 54.4 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 223.10309 |
| Heavy Atoms | 15 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 18312-38-4 |
|---|---|
| SMILES | CCCCCNC(=O)SC1=CC=CC=C1 |
| InChIKey | SKDVDMGVQIHVGC-UHFFFAOYSA-N |
📖 Product Overview
Pentylthiocarbamic acid S-phenyl ester (CAS: 18312-38-4) is a chemical compound with molecular formula C12H17NOS and molecular weight 223.34 g/mol. Its IUPAC systematic name is S-phenyl N-pentylcarbamothioate.
SKDVDMGVQIHVGC-UHFFFAOYSA-N.
SMILES: CCCCCNC(=O)SC1=CC=CC=C1.
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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📚 Academic Support
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