chempirical

2-Chloro-4-fluoro-1-methoxybenzene

C7H6ClFOCAS 2267-25-6160.57 g/mol

Open in Covalent MOL file
OFCl
Aryl halideEther

Properties

Molecular formula
C7H6ClFO
Molar mass
160.57 g/mol
Exact mass
160.0091 Da
Boiling point
67 °C (at 5 Torr)
logP
2.49Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Identifiers

CAS number
2267-25-6
SMILES
COc1ccc(F)cc1Cl
InChIKey
RKCGJVGMRPKPNY-UHFFFAOYSA-N
InChI
InChI=1S/C7H6ClFO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,1H3

Weigh it out

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

Names and synonyms

3 names
  • Benzene, 2-chloro-4-fluoro-1-methoxy-
  • Anisole, 2-chloro-4-fluoro-
  • 2-Chloro-4-fluoroanisole

Work with 2-Chloro-4-fluoro-1-methoxybenzene

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-Chloro-1,4-dimethoxybenzene2100-42-760 % similar 2,4-Difluoroanisole452-10-860 % similar 4-Fluoro-1-methoxy-2-methylbenzene399-54-258 % similar 2-Bromo-4-fluoro-1-methoxybenzene452-08-456 % similar 3-Chloro-4-methoxyaniline5345-54-056 % similar 1,4-Dichloro-2,5-dimethoxybenzene2675-77-656 % similar 2-Chloroanisole766-51-855 % similar 1,4-Difluoro-2-methoxybenzene75626-17-455 % similar

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

Same formula

2-Chloro-1-fluoro-4-methoxybenzene202925-07-3 1-Chloro-3-fluoro-5-methoxybenzene202925-08-4 2-Chloro-5-fluorobenzenemethanol261762-59-8 1-Chloro-4-fluoro-2-methoxybenzene450-89-5 4-Chloro-2-fluoro-1-methoxybenzene452-09-5 1-Chloro-2-fluoro-4-methoxybenzene501-29-1 4-Chloro-2-fluorobenzenemethanol56456-49-6 2-Chloro-6-fluorobenzenemethanol56456-50-9

Elsewhere

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