Basic information
- CAS
106730-50-1- Standard SMILES
CC(=O)OCCS(=O)Cl- InChIKey
JUVXJMHLUKQGQX-UHFFFAOYSA-N- Molecular formula
- C4H7ClO3S
- Average molar mass
- 170.62 g/mol
- Monoisotopic mass
- 169.9804429
Names & identifiers
- Preferred name
- 2-(Chlorosulfinyl)ethyl acetate
- IUPAC
- 2-chlorosulfinylethyl acetate
Names & synonyms
2-(Chlorosulfinyl)ethyl acetate106730-50-1DTXSID20544774RefChem:253585DTXCID60495559SCHEMBL24505538EN300-732322
Database identifiers
- CAS
106730-50-1- PubChem CID
- 13601322
- DTXSID
DTXSID20544774
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 62.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 125
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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