Acetic acid, ((2,2-dichloroethenyl)thio)-
Basic information
- CAS
77922-51-1- Standard SMILES
O=C(O)CSC=C(Cl)Cl- InChIKey
RPZLCAJDJDKTDL-UHFFFAOYSA-N- Molecular formula
- C4H4Cl2O2S
- Average molar mass
- 187.04 g/mol
- Monoisotopic mass
- 185.9309059
Names & identifiers
- Preferred name
- Acetic acid, ((2,2-dichloroethenyl)thio)-
- IUPAC
- 2-(2,2-dichloroethenylsulfanyl)acetic acid
Names & synonyms
Acetic acid, ((2,2-dichloroethenyl)thio)-77922-51-1DTXSID00228580RefChem:315876DTXCID50151071SCHEMBL10332355(2,2-dichloro-vinylsulfanyl)acetic acid[(2,2-Dichloroethen-1-yl)sulfanyl]acetic acid
Database identifiers
- CAS
77922-51-1- PubChem CID
- 55674
- DTXSID
DTXSID00228580
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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