Basic information
- Standard SMILES
CC(C(=O)O)c1ccc(-c2ccccc2[N+](=O)[O-])cc1- InChIKey
CXIVVPGEXBMVMV-UHFFFAOYSA-N- Molecular formula
- C15H13NO4
- Average molar mass
- 271.27 g/mol
Names & identifiers
- Preferred name
- 2-(2'-Nitro-4-biphenylyl)propionic acid
- IUPAC
- 2-[4-(2-nitrophenyl)phenyl]propanoic acid
Names & synonyms
SCHEMBL11672909CXIVVPGEXBMVMV-UHFFFAOYSA-N2-(2'-nitro-4-biphenylyl)propionic acid2-(2'-nitro-4-biphenylyl)-propionic acid
Database identifiers
- PubChem CID
- 21453327
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 357
Related reactions
6 records
Compound notes
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