Acetic acid, 2-chloro-, (3(or 4)-ethenylphenyl)methyl ester
Basic information
- CAS
71423-38-6- Standard SMILES
C=Cc1ccc(COC(=O)CCl)cc1- InChIKey
ZCQMTVVJUCDYSS-UHFFFAOYSA-N- Molecular formula
- C11H11ClO2
- Average molar mass
- 210.65 g/mol
- Monoisotopic mass
- 210.0447573
Names & identifiers
- Preferred name
- Acetic acid, 2-chloro-, (3(or 4)-ethenylphenyl)methyl ester
- IUPAC
- (4-ethenylphenyl)methyl 2-chloroacetate
Names & synonyms
Chloroacetic acid, 3(or 4)-ethenylbenzyl esterAcetic acid, chloro-, (3(or 4)-ethenylphenyl)methyl esterAcetic acid, chloro-, [3(or 4)-ethenylphenyl]methyl esterDTXSID1072347Acetic acid, 2-chloro-, (3(or 4)-ethenylphenyl)methyl esterAcetic acid, 2-chloro-, [3(or 4)-ethenylphenyl]methyl esterRefChem:108924DTXCID204701271423-38-6SCHEMBL4933160ZCQMTVVJUCDYSS-UHFFFAOYSA-N(4-Ethenylphenyl)methyl chloroacetate
Database identifiers
- CAS
71423-38-6- PubChem CID
- 3085462
- DTXSID
DTXSID1072347
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 195
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationAcetic acid, 2-chloro-, [3(or 4)-ethenylphenyl]methyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…