2,6-Difluorobenzaldehyde oxime

C₇H₅F₂NOCAS 19064-16-5157.12 g/mol

Open in Covalent MOL file

Aryl halide Oxime

Properties

Molecular formula: C₇H₅F₂NO
Molar mass: 157.12 g/mol
Exact mass: 157.0339 Da
Melting point: 114.5–115 °C
logP: 1.77Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

19064-16-5

SMILES

ON=Cc1c(F)cccc1F

InChIKey

PGWOZJHFLGQGDU-UHFFFAOYSA-N

InChI

InChI=1S/C7H5F2NO/c8-6-2-1-3-7(9)5(6)4-10-11/h1-4,11H

Weigh it out

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

Names and synonyms

1 names

Benzaldehyde, 2,6-difluoro-, oxime

Work with 2,6-Difluorobenzaldehyde oxime

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-6-fluorobenzaldehyde oxime443-33-475 % similar 2,6-Dichlorobenzaldehyde oxime25185-95-954 % similar 2,6-Difluorobenzaldehyde437-81-046 % similar [C(Z)]-4-Fluorobenzaldehyde oxime588-95-443 % similar Benzaldehyde oxime932-90-143 % similar 2,6-Difluorophenol28177-48-241 % similar 2-Chlorobenzaldehyde oxime3717-28-041 % similar trans-2,6-Difluorocinnamic acid102082-89-340 % similar

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

Same formula

3,5-Difluorobenzamide132980-99-5 2,6-Difluorobenzamide18063-03-1 2,3-Difluorobenzamide18355-75-4 2,4-Difluorobenzamide85118-02-1 2,5-Difluorobenzamide85118-03-2 3,4-Difluorobenzamide85118-04-3

Elsewhere

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