Basic information
- Standard SMILES
CC(C)COc1ccc(COc2ccc(CC(=O)O)cc2Cl)cc1Cl- InChIKey
DGGTZSYAMNWDGI-UHFFFAOYSA-N- Molecular formula
- C19H20Cl2O4
- Average molar mass
- 383.3 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-4-(3'-chloro-4'-isobutoxybenzyloxy) phenylacetic acid
- IUPAC
- 2-[3-chloro-4-[[3-chloro-4-(2-methylpropoxy)phenyl]methoxy]phenyl]acetic acid
Names & synonyms
SCHEMBL11460696DGGTZSYAMNWDGI-UHFFFAOYSA-N3-chloro-4-(3'-chloro-4'-isobutoxybenzyloxy) phenylacetic acid
Database identifiers
- PubChem CID
- 53758658
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 418
Related reactions
1 records
Compound notes
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