Basic information
- Standard SMILES
O.O=S(Cl)Cl- InChIKey
CWYJPCMADWJLIY-UHFFFAOYSA-N- Molecular formula
- Cl2H2O2S
- Average molar mass
- 136.99 g/mol
Names & identifiers
- Preferred name
- Thionylchloride water
- IUPAC
- thionyl dichloride;hydrate
Names & synonyms
thionylchloride waterthionyl chloride waterSOCl2 H2OSCHEMBL27328013CWYJPCMADWJLIY-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86607486
Properties
Computed structural properties
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 29
Related reactions
6 records
Compound notes
Loading…