Basic information
- CAS
56052-53-0- Standard SMILES
O=C(CCc1ccccc1O)c1ccccc1- InChIKey
QYBJSUYYMXLWIU-UHFFFAOYSA-N- Molecular formula
- C15H14O2
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.09937969
Names & identifiers
- Preferred name
- 3-(2-Hydroxyphenyl)-1-phenylpropan-1-one
- IUPAC
- 3-(2-hydroxyphenyl)-1-phenylpropan-1-one
- English name
- 3-(2-hydroxyphenyl)-1-phenylpropan-1-one
- Molecular formula
- C15H14O2
- Molecular weight
- 226.27
Names & synonyms
3-(2-Hydroxyphenyl)-1-phenylpropan-1-one56052-53-0EINECS 259-969-51-Propanone,3-(2-hydroxyphenyl)-1-phenyl-1-Propanone, 3-(2-hydroxyphenyl)-1-phenyl-CHEMBL446876SCHEMBL13026690DTXSID80204605AKOS022422099NS000334493-(2-Hydroxyphenyl)-1-phenyl-1-propanone #3-(2-Hydroxyphenyl)-1-phenyl-1-propanone, 97%
Show more names
3-(2-Hydroxyphenyl)-1-phenyl-1-propanone1-Phenyl-3-(2-hydroxyphenyl)-1-propanone
Database identifiers
- CAS
56052-53-0- PubChem CID
- 91996
- DTXSID
DTXSID80204605- ChEMBL
CHEMBL446876- EC Number
- 259-969-5
- Nikkaji
- J122.346A
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Melting point
- 154 · 154-156 °C
- Boiling point
- 402.6 · 402.6±28.0 °C(Predicted)
- Density
- 1.15 · 1.150±0.06 g/cm3(Predicted)
- pka
- 10.17 · 10.17±0.30(Predicted)
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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