2,2-Difluoro-2-(pyridin-4-yl)-ethanol

HCID 59633907

Notes Reactions

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Basic information

CAS: 1255305-77-1
Standard SMILES: OCC(F)(F)c1ccncc1
InChIKey: AWGLOEVVEXGBCW-UHFFFAOYSA-N
Molecular formula: C7H7F2NO
Average molar mass: 159.13 g/mol
Monoisotopic mass: 159.04957017

Names & identifiers

Preferred name: 2,2-Difluoro-2-(pyridin-4-yl)-ethanol
IUPAC: 2,2-difluoro-2-pyridin-4-ylethanol

Names & synonyms

2,2-difluoro-2-(pyridin-4-yl)ethan-1-ol1255305-77-12,2-Difluoro-2-(pyridin-4-yl)-ethanol2,2-Difluoro-2-(pyridin-4-yl)ethanolSCHEMBL742861DTXSID0013064834-Pyridineethanol, beta,beta-difluoro-I(2),I(2)-Difluoro-4-pyridineethanolDB-111679EN300-1930540

Database identifiers

CAS: 1255305-77-1
PubChem CID: 59633907
DTXSID: DTXSID001306483

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 33.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 11
Formal charge: 0
Complexity: 124

Related reactions

2 records

New reaction record

HRID 1615086As productuspto-grants-2014_07

HRID 1615087As reactantuspto-grants-2014_07

Compound notes

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