3-Chloro-5-fluorophenol

C₆H₄ClFOCAS 202982-70-5146.55 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₆H₄ClFO
Molar mass: 146.55 g/mol
Exact mass: 145.9935 Da
logP: 2.18Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

202982-70-5

SMILES

Oc1cc(F)cc(Cl)c1

InChIKey

ZMFBYTAAMHWQHD-UHFFFAOYSA-N

InChI

InChI=1S/C6H4ClFO/c7-4-1-5(8)3-6(9)2-4/h1-3,9H

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Names and synonyms

1 names

Phenol, 3-chloro-5-fluoro-

Work with 3-Chloro-5-fluorophenol

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

1,3-Dichloro-5-fluorobenzene1435-46-764 % similar 3,5-Difluorophenol2713-34-064 % similar 3,5-Dichlorophenol591-35-564 % similar 3-Fluoro-5-methylphenol216976-31-752 % similar 3-Fluorophenol372-20-350 % similar 3-Chloro-5-fluorobenzenamine4863-91-650 % similar 3-Bromo-5-chlorophenol56962-04-050 % similar B-(3-Fluoro-5-hydroxyphenyl)boronic acid871329-82-747 % similar

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

Same formula

2-Chloro-4-fluorophenol1996-41-4 2-Chloro-6-fluorophenol2040-90-6 3-Chloro-4-fluorophenol2613-23-2 4-Chloro-3-fluorophenol348-60-7 4-Chloro-2-fluorophenol348-62-9 2-Chloro-5-fluorophenol3827-49-4

Elsewhere

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