Basic information
- CAS
6625-04-3- Standard SMILES
CC(Cl)C(=O)Oc1ccc(Cl)cc1- InChIKey
ZTFHVLFFQQCYQH-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O2
- Average molar mass
- 219.06 g/mol
- Monoisotopic mass
- 217.9901349
Names & identifiers
- Preferred name
- 4-Chlorophenyl 2-chloropropanoate
- IUPAC
- (4-chlorophenyl) 2-chloropropanoate
- English name
- (4-chlorophenyl) 2-chloropropanoate
- Molecular formula
- C9H8Cl2O2
- Molecular weight
- 219.06
Names & synonyms
4-chlorophenyl 2-chloropropanoate6625-04-3DTXSID70288035RefChem:292142DTXCID102391822-Chloropropionic acid, 4-chlorophenyl esterNSC53875ZTFHVLFFQQCYQH-UHFFFAOYSA-NNSC-53875(4-chlorophenyl) 2-chloropropanoatePropanoic acid, 2-chloro-, 4-chlorophenyl ester
Database identifiers
- CAS
6625-04-3- PubChem CID
- 243732
- DTXSID
DTXSID70288035
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Physicochemical properties
- Boiling point
- 77 · 77-79 °C(Press: 0.2 Torr)
- Density
- 1.4239 g/cm3 · 1.4239 g/cm3
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…