Butanoic acid, 2-chlorophenyl ester
Basic information
- CAS
63867-11-8- Standard SMILES
CCCC(=O)Oc1ccccc1Cl- InChIKey
RPQLJCLHDBGBSE-UHFFFAOYSA-N- Molecular formula
- C10H11ClO2
- Average molar mass
- 198.64 g/mol
- Monoisotopic mass
- 198.0447573
Names & identifiers
- Preferred name
- Butanoic acid, 2-chlorophenyl ester
- IUPAC
- (2-chlorophenyl) butanoate
- English name
- Butyric acid o-chlorophenyl ester
- Molecular formula
- C10H11ClO2
- Molecular weight
- 198.65
Names & synonyms
BUTYRIC ACID, o-CHLOROPHENYL ESTERo-Chlorophenyl butyrateButanoic acid, 2-chlorophenyl esterDTXSID40213298NSC 53054RefChem:330725DTXCID40135789RPQLJCLHDBGBSE-UHFFFAOYSA-N63867-11-82-CHLOROPHENYL BUTANOATEButyric acid o-chlorophenyl ester2-chlorophenol n-butyrate
Show more names
2-Chlorophenyl butyrate #SCHEMBL6917578NSC53054NSC-53054AKOS003027959DB-307696
Database identifiers
- CAS
63867-11-8- PubChem CID
- 44842
- DTXSID
DTXSID40213298- Nikkaji
- J65.877D
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 170
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Compound notes
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