Basic information
- CAS
5446-34-4- Standard SMILES
O=C(CCl)O[C@@H]1CCC[C@H]1O- InChIKey
UBALGCJLQRTHLH-PHDIDXHHSA-N- Molecular formula
- C7H11ClO3
- Average molar mass
- 178.61 g/mol
- Monoisotopic mass
- 178.0396719
Names & identifiers
- Preferred name
- (1r,2r)-2-Hydroxycyclopentyl chloroacetate
- IUPAC
- [(1R,2R)-2-hydroxycyclopentyl] 2-chloroacetate
Names & synonyms
5446-34-4(1r,2r)-2-hydroxycyclopentyl chloroacetateNSC17203DTXSID30280510NSC-17203
Database identifiers
- CAS
5446-34-4- PubChem CID
- 226591
- DTXSID
DTXSID30280510- Nikkaji
- J1.788.557J
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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