Basic information
- CAS
17027-67-7- Standard SMILES
COc1ccc(-c2ccc(CC(=O)O)cc2)cc1Cl- InChIKey
PAQBVXZQBVWFKD-UHFFFAOYSA-N- Molecular formula
- C15H13ClO3
- Average molar mass
- 276.71 g/mol
- Monoisotopic mass
- 276.055322
Names & identifiers
- Preferred name
- 3'-Chloro-4'-methoxy(1,1'-biphenyl)-4-acetic acid
- IUPAC
- 2-[4-(3-chloro-4-methoxyphenyl)phenyl]acetic acid
Names & synonyms
17027-67-74-BIPHENYLACETIC ACID, 3'-CHLORO-4'-METHOXY-DTXSID30168824RefChem:1065400DTXCID90913153'-Chloro-4'-methoxy(1,1'-biphenyl)-4-acetic acidBRN 26550972-(4-(3'-Chloro-4'-methoxy)biphenylyl)acetic acid[1,1'-Biphenyl]-4-aceticacid, 3'-chloro-4'-methoxy-(3'-Chloro-4'-methoxy[1,1'-biphenyl]-4-yl)acetic acid3 inverted exclamation marka-Chloro-4 inverted exclamation marka-methoxy[1,1 inverted exclamation marka-biphenyl]-4-acetic acid
Database identifiers
- CAS
17027-67-7- PubChem CID
- 28208
- DTXSID
DTXSID30168824
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…