2,3-Dihydroxy-1,2-diphenylpropan-1-one
Basic information
- CAS
15121-78-5- Standard SMILES
O=C(c1ccccc1)C(O)(CO)c1ccccc1- InChIKey
AOGNACZDZNOTSN-UHFFFAOYSA-N- Molecular formula
- C15H14O3
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.0942943
Names & identifiers
- Preferred name
- 2,3-Dihydroxy-1,2-diphenylpropan-1-one
- IUPAC
- 2,3-dihydroxy-1,2-diphenylpropan-1-one
- English name
- 2,3-dihydroxy-2-phenylpropiophenone
- Molecular formula
- C15H14O3
- Molecular weight
- 242.26986
Names & synonyms
2,3-dihydroxy-1,2-diphenylpropan-1-one15121-78-5alpha-methylolbenzoin2,3-dihydroxy-1,2-diphenyl-1-propanoneEINECS 239-177-6alphamethylol benzoin2,3-Dihydroxy-2-phenylpropiophenonealpha-methylol benzoinJN4ZNS4LMZ2,3-Dihydroxy-1,2-di(phenyl)propan-1-onealpha-hydroxymethyl benzoinSCHEMBL36374
Show more names
α-(Hydroxymethyl)benzoinALPHA-(Hydroxymethyl)-benzoinα-Hydroxy-α-(hydroxymethyl)deoxybenzoin
Benzoin, alpha-(hydroxymethyl)-DTXSID909341882,3-dihydroxy-1,2-diphenyl-propan-1-one1-Propanone, 2,3-dihydroxy-1,2-diphenyl-NS00051381
Database identifiers
- CAS
15121-78-5- PubChem CID
- 85806
- DTXSID
DTXSID90934188- UNII
- JN4ZNS4LMZ
- EC Number
- 239-177-6
- Nikkaji
- J241.409K
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Melting point
- 85.5 °C · 85.5 °C
- Boiling point
- 460.5 · 460.5±45.0 °C(Predicted)
- Density
- 1.248 · 1.248±0.06 g/cm3(Predicted)
- pka
- 11.53 · 11.53±0.29(Predicted)
Related reactions
16 records
Compound notes
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