Cyclohexyl 2-chloropropanoate
Basic information
- CAS
54819-87-3- Standard SMILES
CC(Cl)C(=O)OC1CCCCC1- InChIKey
OHRNNGVUQOZQNK-UHFFFAOYSA-N- Molecular formula
- C9H15ClO2
- Average molar mass
- 190.67 g/mol
- Monoisotopic mass
- 190.0760574
Names & identifiers
- Preferred name
- Cyclohexyl 2-chloropropanoate
- IUPAC
- cyclohexyl 2-chloropropanoate
Names & synonyms
cyclohexyl 2-chloropropanoate54819-87-3DTXSID10323636RefChem:335677DTXCID90274753NSC404502SCHEMBL210325SBB061231AKOS006292306NSC-404502ST51047275
Database identifiers
- CAS
54819-87-3- PubChem CID
- 346308
- DTXSID
DTXSID10323636
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…