Benzoic acid, p-chlorothio-, S-2,3-epithiopropyl ester
S-(thiiran-2-ylmethyl) 4-chlorobenzenecarbothioate
Also Known As: Episulphide deriv.|BRL 649|RefChem:327933|AC1L1T5H|BRN 1284886|p-Chlorothiobenzoic acid S-2,3-epithiopropyl ester|S-(thiiran-2-ylmethyl) 4-chlorobenzenecarbothioate|5-17-03-00055 (Beilstein Handbook Reference)|4-Chlorophenyl thiiran-2-ylmethylthio ketone|S-(thiiran-2-ylmethyl) 4-chlorobenzothioate|BENZOIC ACID, p-CHLOROTHIO-, S-2,3-EPITHIOPROPYL ESTER|S-[(Thiiran-2-yl)methyl] 4-chlorobenzene-1-carbothioate
| Molecular Formula | C10H9ClOS2 |
|---|---|
| Molecular Weight | 243.97833 g/mol |
| LogP | 3.33 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.97833 |
| Heavy Atoms | 14 |
| Complexity | 332.5 |
Chemical Identifiers
| CAS Number | 109963-13-5 |
|---|---|
| SMILES | C1C(S1)CSC(=O)C2=CC=C(C=C2)Cl |
Product Overview
Benzoic acid, p-chlorothio-, S-2,3-epithiopropyl ester (CAS 109963-13-5), with molecular formula C10H9ClOS2 and molecular weight 243.97833 g/mol. IUPAC: S-(thiiran-2-ylmethyl) 4-chlorobenzenecarbothioate.
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