Basic information
- CAS
61888-56-0- Standard SMILES
CCCOc1cc(CC(=O)O)cc(-c2ccccc2)c1- InChIKey
ADRLSZAQHXDOME-UHFFFAOYSA-N- Molecular formula
- C17H18O3
- Average molar mass
- 270.32 g/mol
- Monoisotopic mass
- 270.12559443
Names & identifiers
- Preferred name
- 3-Biphenylacetic acid, 5-propoxy-
- IUPAC
- 2-(3-phenyl-5-propoxyphenyl)acetic acid
- English name
- 5-Propoxy-3-biphenylacetic acid
- Molecular formula
- C17H18O3
- Molecular weight
- 270.32
Names & synonyms
5-Propoxy-3-biphenylacetic acid61888-56-03-BIPHENYLACETIC ACID, 5-PROPOXY-BRN 2126043DTXSID20210881RefChem:277123DTXCID50133372CHEMBL3244532DB-317805(5-Propoxy[1,1'-biphenyl]-3-yl)acetic acidReaxys ID: 21260435-Propoxy-1,1'-biphenyl-3-acetic acid
Show more names
[1,1'-Biphenyl]-3-acetic acid, 5-propoxy-
Database identifiers
- CAS
61888-56-0- PubChem CID
- 43835
- DTXSID
DTXSID20210881- ChEMBL
CHEMBL3244532- Nikkaji
- J79.011G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 297
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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