Basic information
- Standard SMILES
CCC(C)OC(=O)SCl- InChIKey
DTXLJJFSKVNYRR-UHFFFAOYSA-N- Molecular formula
- C5H9ClO2S
- Average molar mass
- 168.64 g/mol
Names & identifiers
- Preferred name
- (1-Methylpropoxycarbonyl)sulfenyl chloride
- IUPAC
- butan-2-yl chlorosulfanylformate
Names & synonyms
SCHEMBL8876881DTXLJJFSKVNYRR-UHFFFAOYSA-N(1-methylpropoxycarbonyl)sulfenyl chloride
Database identifiers
- PubChem CID
- 13633290
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 97
Related reactions
4 records
Compound notes
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