Benzenecarbodithioic acid, ethyl ester
ethyl benzenecarbodithioate
Also Known As: Ethyl dithiobenzoate|Ethyl benzenecarbodithioate|Benzenecarbodithioic acid, ethyl ester|Dithiobenzoesaeure-aethylester|Ethyl benzenecarbodithioate #|Benzenecarbodithioicacidethylester|Benzoic acid, dithio-, ethyl ester|Benzenecarbodithioic acid ethyl ester
CAS: 936-63-0
| Molecular Formula | C9H10S2 |
|---|---|
| Molecular Weight | 182.0224 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.0224 |
| Monoisotopic Mass | 182.0224 |
| Heavy Atoms | 11 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 936-63-0 |
|---|---|
| SMILES | CCSC(=S)C1=CC=CC=C1 |
| InChIKey | IKQMQWBFIXCPID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (41 patents)
Pharmaceutical Intermediates (8 patents)
Product Overview
Benzenecarbodithioic acid, ethyl ester (CAS 936-63-0), with molecular formula C9H10S2 and molecular weight 182.0224 g/mol. IUPAC: ethyl benzenecarbodithioate.
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.
View MSDS →
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