Basic information
- CAS
5410-13-9- Standard SMILES
CCC(=O)c1cccc(-c2ccccc2)c1CC- InChIKey
VDGRKNQCFIEKRG-UHFFFAOYSA-N- Molecular formula
- C17H18O
- Average molar mass
- 238.32 g/mol
- Monoisotopic mass
- 238.13576519
Names & identifiers
- Preferred name
- 1-(2-Ethylbiphenyl-3-yl)propan-1-one
- IUPAC
- 1-(2-ethyl-3-phenylphenyl)propan-1-one
Names & synonyms
MLS0026382785410-13-91-(2-ethylbiphenyl-3-yl)propan-1-oneHMS3091B09NSC12581CHEMBL1715931DTXSID80279398NSC-12581SMR0015477671-(2-Ethyl[1,1'-biphenyl]-3-yl)propan-1-one
Database identifiers
- CAS
5410-13-9- PubChem CID
- 224232
- DTXSID
DTXSID80279398- ChEMBL
CHEMBL1715931
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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