Basic information
- CAS
116254-66-1- Standard SMILES
OC(Cl)(CCl)CCl- InChIKey
WUGLLMGIZBHYAZ-UHFFFAOYSA-N- Molecular formula
- C3H5Cl3O
- Average molar mass
- 163.43 g/mol
- Monoisotopic mass
- 161.940598
Names & identifiers
- Preferred name
- 1,2,3-Trichloropropan-2-ol
- IUPAC
- 1,2,3-trichloropropan-2-ol
Names & synonyms
116254-66-11,2,3-Trichloropropan-2-olSCHEMBL9649257DTXSID20601836
Database identifiers
- CAS
116254-66-1- PubChem CID
- 20032397
- DTXSID
DTXSID20601836
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 52.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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