Basic information
- Standard SMILES
CC(=O)CCC(=S)Cl- InChIKey
UNUDUTMFKRKUIJ-UHFFFAOYSA-N- Molecular formula
- C5H7ClOS
- Average molar mass
- 150.63 g/mol
Names & identifiers
- Preferred name
- 3-Acetylthiopropionyl chloride
- IUPAC
- 4-oxopentanethioyl chloride
Names & synonyms
3-acetylthiopropionyl chlorideSCHEMBL7348046UNUDUTMFKRKUIJ-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 20041315
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 111
Related reactions
20 records
Compound notes
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