(2,4-Dichlorophenyl) propanoate
Basic information
- CAS
26628-14-8- Standard SMILES
CCC(=O)Oc1ccc(Cl)cc1Cl- InChIKey
FXRBLZFPWONVMH-UHFFFAOYSA-N- Molecular formula
- C9H8Cl2O2
- Average molar mass
- 219.06 g/mol
- Monoisotopic mass
- 217.9901349
Names & identifiers
- Preferred name
- (2,4-Dichlorophenyl) propanoate
- IUPAC
- (2,4-dichlorophenyl) propanoate
Names & synonyms
(2,4-dichlorophenyl) propanoate26628-14-8DTXSID70322988RefChem:205508DTXCID402741072,4-DICHLOROPHENYL PROPANOATENSC402625SCHEMBL1678635SCHEMBL9799896AKOS017060009NSC-402625
Database identifiers
- CAS
26628-14-8- PubChem CID
- 345199
- DTXSID
DTXSID70322988
Properties
Computed structural properties
- XLogP
- 3.1
- 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
- 184
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Compound notes
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