Basic information
- CAS
2294-74-8- Standard SMILES
OC(Cc1ccccn1)c1ccccc1- InChIKey
NPVKVVBMSCQGAS-UHFFFAOYSA-N- Molecular formula
- C13H13NO
- Average molar mass
- 199.25 g/mol
- Monoisotopic mass
- 199.09971404
Names & identifiers
- Preferred name
- alpha-Phenylpyridine-2-ethanol
- IUPAC
- 1-phenyl-2-pyridin-2-ylethanol
- English name
- alpha-phenylpyridine-2-ethanol
- Molecular formula
- C13H13NO
- Molecular weight
- 199.24842
Names & synonyms
2294-74-81-Phenyl-2-(pyridin-2-yl)ethan-1-ol2-(2-Hydroxy-2-phenylethyl)pyridinealpha-Phenylpyridine-2-ethanol1-phenyl-2-pyridin-2-ylethanol2-Pyridineethanol, a-phenyl-1-phenyl-2-(2-pyridyl)ethanolNSC9497EINECS 218-936-5SCHEMBL302719SCHEMBL5191490SCHEMBL9491676
Show more names
α-Phenyl-2-pyridineethanol2-Pyridineethanol, α-phenyl-2-(β-Hydroxyphenethyl)pyridineα-Methyl-α-phenyl-2-pyridinemethanolα-Methyl-α-(2-pyridyl)benzyl alcohol
I+/--Phenyl-2-pyridineethanolNPVKVVBMSCQGAS-UHFFFAOYSA-N1-phenyl-2-(2-pyridinyl)ethanolDTXSID401310907KFA38453NSC 9497NSC-9497DS-013710
Database identifiers
- CAS
2294-74-8- PubChem CID
- 95435
- DTXSID
DTXSID401310907- EC Number
- 218-936-5
- Nikkaji
- J213.169B
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Melting point
- 108 · 108-110 °C
- Boiling point
- 317.5 · 317.5±27.0 °C(Predicted)
- Density
- 1.142 · 1.142±0.06 g/cm3(Predicted)
- pka
- 13.68 · 13.68±0.20(Predicted)
Chemistry & industry
Suppliers1 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
2 records
Compound notes
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