2-Chloro-4-(3,5-dichloro-4-methylphenyl)-4-oxobutyric acid
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Basic information
- Standard SMILES
Cc1c(Cl)cc(C(=O)CC(Cl)C(=O)O)cc1Cl- InChIKey
MBBZKRZDMCTHRW-UHFFFAOYSA-N- Molecular formula
- C11H9Cl3O3
- Average molar mass
- 295.5 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-4-(3,5-dichloro-4-methylphenyl)-4-oxobutyric acid
- IUPAC
- 2-chloro-4-(3,5-dichloro-4-methylphenyl)-4-oxobutanoic acid
Names & synonyms
SCHEMBL10898268MBBZKRZDMCTHRW-UHFFFAOYSA-N2-chloro-4-(3,5-dichloro-4-methylphenyl)-4-oxobutyric acid
Database identifiers
- PubChem CID
- 13420344
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 296
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Related reactions
3 records
Compound notes
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