(2,4-Dichloro-6-phenylphenyl)butanoate
Basic information
- CAS
7495-14-9- Standard SMILES
CCCC(=O)Oc1c(Cl)cc(Cl)cc1-c1ccccc1- InChIKey
LJNGGLUDCYLCQV-UHFFFAOYSA-N- Molecular formula
- C16H14Cl2O2
- Average molar mass
- 309.2 g/mol
- Monoisotopic mass
- 308.0370851
Names & identifiers
- Preferred name
- (2,4-Dichloro-6-phenylphenyl)butanoate
- IUPAC
- (2,4-dichloro-6-phenylphenyl) butanoate
Names & synonyms
7495-14-9(2,4-dichloro-6-phenylphenyl)butanoateNSC404413DTXSID40323609NSC-4044133,5-Dichloro[1,1'-biphenyl]-2-yl butanoate
Database identifiers
- CAS
7495-14-9- PubChem CID
- 346247
- DTXSID
DTXSID40323609
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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