chempirical

2,5-Difluorobenzenemethanol

C7H6F2OCAS 75853-20-2144.12 g/mol

Open in Covalent MOL file
HOFF
AlcoholAryl halide

Properties

Molecular formula
C7H6F2O
Molar mass
144.12 g/mol
Exact mass
144.0387 Da
logP
1.46Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
75853-20-2
SMILES
OCc1cc(F)ccc1F
InChIKey
KIKCAPPVFQLOIU-UHFFFAOYSA-N
InChI
InChI=1S/C7H6F2O/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4H2

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Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • Benzenemethanol, 2,5-difluoro-
  • 2,5-Difluorobenzyl alcohol
  • (2,5-Difluorophenyl)methanol

Work with 2,5-Difluorobenzenemethanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Bromo-5-fluorobenzenemethanol202865-66-560 % similar 2-Chloro-5-fluorobenzenemethanol261762-59-860 % similar 5-Bromo-2-fluorobenzenemethanol99725-13-060 % similar 2,5-Difluorobenzyl bromide85117-99-359 % similar 2,5-Difluorobenzenemethanamine85118-06-559 % similar 5-Fluoro-2-(trifluoromethyl)benzenemethanol238742-82-056 % similar 2-Fluorobenzyl alcohol446-51-554 % similar 2,5-Difluorobenzeneacetonitrile69584-87-853 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,2-Difluoro-4-methoxybenzene115144-40-6 1,2-Difluoro-3-methoxybenzene134364-69-5 2,6-Difluorobenzenemethanol19064-18-7 1,3-Difluoro-2-methoxybenzene437-82-1 2,4-Difluoroanisole452-10-8 (Difluoromethoxy)benzene458-92-4 2,4-Difluorobenzenemethanol56456-47-4 1,4-Difluoro-2-methoxybenzene75626-17-4

Elsewhere

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