chloromethanethioic S-acid;S-(chloromethyl) ethanethioate
Basic information
- CAS
2812-73-9- Standard SMILES
CC(=O)SCCl.O=C(S)Cl- InChIKey
ZFJKVFJMGDXNKD-UHFFFAOYSA-N- Molecular formula
- C4H6Cl2O2S2
- Average molar mass
- 221.1 g/mol
- Monoisotopic mass
- 219.9186272
Names & identifiers
- Preferred name
- chloromethanethioic S-acid;S-(chloromethyl) ethanethioate
- IUPAC
- chloromethanethioic S-acid;S-(chloromethyl) ethanethioate
Names & synonyms
DTXSID00950859chloromethanethioic S-acid;S-(chloromethyl) ethanethioateCarbonochloridothioic S-acid--S-(chloromethyl) ethanethioate (1/1)Carbonochloridothioic S-acid--S-chloromethyl ethanethioate (1/1)
Database identifiers
- CAS
2812-73-9- PubChem CID
- 17773
- DTXSID
DTXSID00950859
Properties
Computed structural properties
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 89.8
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Compound notes
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