Basic information
- Standard SMILES
O=C(Cl)C1=CSCCS1- InChIKey
LNJQBOIJIVCERN-UHFFFAOYSA-N- Molecular formula
- C5H5ClOS2
- Average molar mass
- 180.7 g/mol
Names & identifiers
- Preferred name
- 5,6-Dihydro-1,4-dithiin-2-carbonyl chloride
- IUPAC
- 2,3-dihydro-1,4-dithiine-5-carbonyl chloride
Names & synonyms
SCHEMBL10661190LNJQBOIJIVCERN-UHFFFAOYSA-N5,6-Dihydro-1,4-dithiin-2-carbonyl chloride
Database identifiers
- PubChem CID
- 20134007
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 155
Related reactions
2 records
Compound notes
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