chempirical

2-Fluoro-6-methoxynitrobenzene

C7H6FNO3CAS 641-49-6171.13 g/mol

Open in Covalent MOL file
OFN+OO−
Aryl halideEtherNitro

Properties

Molecular formula
C7H6FNO3
Molar mass
171.13 g/mol
Exact mass
171.0332 Da
logP
1.74Crippen estimate
Polar surface area
52.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

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
641-49-6
SMILES
COC1=C(C(=CC=C1)F)[N+](=O)[O-]
InChIKey
GMWOSSBFNSZKAH-UHFFFAOYSA-N
InChI
InChI=1S/C7H6FNO3/c1-12-6-4-2-3-5(8)7(6)9(10)11/h2-4H,1H3

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Names and synonyms

1 names
  • 1-Fluoro-3-methoxy-2-nitrobenzene

Work with 2-Fluoro-6-methoxynitrobenzene

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

1,3-Difluoro-2-nitrobenzene19064-24-568 % similar 1-Bromo-3-methoxy-2-nitrobenzene500298-30-664 % similar 1-Methoxy-3-methyl-2-nitrobenzene5345-42-664 % similar 1-Fluoro-3-methyl-2-nitrobenzene3013-27-261 % similar 3-Fluoro-2-nitrobenzenamine567-63-561 % similar 3-Methoxy-2-nitrobenzaldehyde53055-05-359 % similar 1-Chloro-3-fluoro-2-nitrobenzene64182-61-258 % similar 1-Bromo-3-fluoro-2-nitrobenzene886762-70-558 % similar

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

Same formula

4-Fluoro-2-nitroanisole445-83-0 5-Fluoro-2-nitroanisole448-19-1 2-Fluoro-1-methoxy-4-nitrobenzene455-93-6 2-Fluoro-6-nitroanisole484-94-6 4-Fluoro-3-nitroanisole61324-93-4

Elsewhere

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