chempirical

1-Chloro-2,5-difluorobenzene

C6H3ClF2CAS 2367-91-1148.54 g/mol

Open in Covalent MOL file
FClF
Aryl halide

Properties

Molecular formula
C6H3ClF2
Molar mass
148.54 g/mol
Exact mass
147.9891 Da
logP
2.62Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
2367-91-1
SMILES
C1=CC(=C(C=C1F)Cl)F
InChIKey
XWCKSJOUZQHFKI-UHFFFAOYSA-N
InChI
InChI=1S/C6H3ClF2/c7-5-3-4(8)1-2-6(5)9/h1-3H

Weigh it out

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

Work with 1-Chloro-2,5-difluorobenzene

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

1,2-Dichloro-4-fluorobenzene1435-49-065 % similar 2,4-Dichlorofluorobenzene1435-48-960 % similar 2-Chloro-1-fluoro-4-methylbenzene1513-25-358 % similar 1,2,4-Trifluorobenzene367-23-757 % similar 2-Chloro-4-fluoro-1-iodobenzene101335-11-956 % similar 1-Bromo-2-chloro-4-fluorobenzene110407-59-556 % similar 2-Chloro-1-fluoro-4-iodobenzene156150-67-356 % similar 2-Chloro-4-fluorothiophenol175277-99-356 % similar

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

Same formula

3,5-Difluorochlorobenzene1435-43-4 1-Chloro-2,4-difluorobenzene1435-44-5 1-Chloro-2,6-difluorobenzene38361-37-4 4-Chloro-1,2-difluorobenzene696-02-6

Elsewhere

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