(E)-3-(3'-acetyl-biphenyl-4-yl)-but-2-en-1-ol
Basic information
- Standard SMILES
CC(=O)c1cccc(-c2ccc(/C(C)=C/CO)cc2)c1- InChIKey
RLLSMBRDWMHLGE-JLHYYAGUSA-N- Molecular formula
- C18H18O2
- Average molar mass
- 266.3 g/mol
Names & identifiers
- Preferred name
- (E)-3-(3'-acetyl-biphenyl-4-yl)-but-2-en-1-ol
- IUPAC
- 1-[3-[4-[(E)-4-hydroxybut-2-en-2-yl]phenyl]phenyl]ethanone
Names & synonyms
SCHEMBL6492519RLLSMBRDWMHLGE-JLHYYAGUSA-N(E)-3-(3'-acetyl-biphenyl-4-yl)-but-2-en-1-ol
Database identifiers
- PubChem CID
- 69799799
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 350
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Related reactions
4 records
Compound notes
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