2-(Difluoromethoxy)nitrobenzene

C₇H₅F₂NO₃CAS 22225-77-0189.12 g/mol

Open in Covalent MOL file

Alkyl halide Ether Nitro

Properties

Molecular formula: C₇H₅F₂NO₃
Molar mass: 189.12 g/mol
Exact mass: 189.0237 Da
logP: 2.20Crippen estimate
Polar surface area: 52.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

22225-77-0

SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])OC(F)F

InChIKey

VICWTNGFGCVEHT-UHFFFAOYSA-N

InChI

InChI=1S/C7H5F2NO3/c8-7(9)13-6-4-2-1-3-5(6)10(11)12/h1-4,7H

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Names and synonyms

1 names

1-(Difluoromethoxy)-2-nitrobenzene

Work with 2-(Difluoromethoxy)nitrobenzene

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-Nitro-2-(1,1,2,2-tetrafluoroethoxy)benzene28202-31-559 % similar 1,1′-[1,2-Ethanediylbis(oxy)]bis[2-nitrobenzene]51661-19-957 % similar O-Nitroanisole91-23-657 % similar 2-(Trifluoromethoxy)nitrobenzene1644-88-857 % similar 2-Nitrodiphenyl ether2216-12-856 % similar 1,2-Dinitrobenzene528-29-053 % similar 1-Fluoro-2-nitrobenzene1493-27-253 % similar 1-Ethoxy-2-nitrobenzene610-67-353 % similar

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

Same formula

1-(Difluoromethoxy)-4-nitrobenzene1544-86-1 3-(Difluoromethoxy)nitrobenzene22236-07-3

Elsewhere

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