Basic information
- Standard SMILES
N#Cc1ccc(-c2ccc(OCC(=O)O)cc2)cc1- InChIKey
WILVZBPZZBVNCS-UHFFFAOYSA-N- Molecular formula
- C15H11NO3
- Average molar mass
- 253.25 g/mol
Names & identifiers
- Preferred name
- 4-(Carboxymethyloxy)-4'-cyano-biphenyl
- IUPAC
- 2-[4-(4-cyanophenyl)phenoxy]acetic acid
Names & synonyms
SCHEMBL4284626WILVZBPZZBVNCS-UHFFFAOYSA-NAKOS0091125254-(Carboxymethyloxy)-4'-cyano-biphenyl[(4'-cyano-1,1'-biphenyl-4-yl)oxy]acetic acid
Database identifiers
- PubChem CID
- 43243100
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 70.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 344
Related reactions
8 records
Compound notes
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