1-Chloro-4-fluoro-2-methoxybenzene

C₇H₆ClFOCAS 450-89-5160.57 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₇H₆ClFO
Molar mass: 160.57 g/mol
Exact mass: 160.0091 Da
logP: 2.49Crippen estimate
Polar surface area: 9.2 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

450-89-5

SMILES

COc1cc(F)ccc1Cl

InChIKey

ULVPJKKERHMKLS-UHFFFAOYSA-N

InChI

InChI=1S/C7H6ClFO/c1-10-7-4-5(9)2-3-6(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, 1-chloro-4-fluoro-2-methoxy-
Anisole, 6-chloro-3-fluoro-
2-Chloro-5-fluoroanisole

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

1,4-Dichloro-2-methoxybenzene1984-58-360 % similar 2,4-Difluoroanisole452-10-860 % similar 1,4-Difluoro-2-methoxybenzene75626-17-460 % similar 1-Chloro-4-fluoro-2-methylbenzene33406-96-157 % similar 5-Bromo-2-chloroanisole16817-43-956 % similar 4-Fluoro-2-methoxyphenol450-93-156 % similar 1,4-Dichloro-2,5-dimethoxybenzene2675-77-656 % similar 1-Chloro-2,4-difluorobenzene1435-44-555 % similar

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

Same formula

3-Chloro-4-fluorobenzyl alcohol161446-90-8 2-Chloro-1-fluoro-4-methoxybenzene202925-07-3 1-Chloro-3-fluoro-5-methoxybenzene202925-08-4 2-Chloro-4-fluoro-1-methoxybenzene2267-25-6 2-Chloro-5-fluorobenzenemethanol261762-59-8 4-Chloro-2-fluoro-1-methoxybenzene452-09-5 1-Chloro-2-fluoro-4-methoxybenzene501-29-1 4-Chloro-2-fluorobenzenemethanol56456-49-6

Elsewhere

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