chempirical

2,6-Dichloro-4-fluorophenol

C6H3Cl2FOCAS 392-71-2180.99 g/mol

Open in Covalent MOL file
HOClFCl
Aryl halidePhenol

Properties

Molecular formula
C6H3Cl2FO
Molar mass
180.99 g/mol
Exact mass
179.9545 Da
Melting point
42 °C
logP
2.84Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
392-71-2
SMILES
Oc1c(Cl)cc(F)cc1Cl
InChIKey
BOJVIFKSTRCIRJ-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl2FO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H

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Names and synonyms

2 names
  • Phenol, 2,6-dichloro-4-fluoro-
  • NSC 10257

Work with 2,6-Dichloro-4-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-2,5-difluorobenzene2367-80-857 % similar 2,4,6-Trichlorophenol88-06-257 % similar 2,6-Dichlorophenol87-65-055 % similar 2,6-Dichloro-4-methylphenol2432-12-454 % similar 4-Bromo-2,6-dichlorophenol3217-15-052 % similar 2,6-Dichloro-4-fluorobenzenamine344-19-452 % similar 4-Amino-2,6-dichlorophenol5930-28-952 % similar 2-Chloro-4-fluorophenol1996-41-452 % similar

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

Elsewhere

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