chempirical

2-Fluoro-6-nitroanisole

C7H6FNO3CAS 484-94-6171.13 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
484-94-6
SMILES
COC1=C(C=CC=C1F)[N+](=O)[O-]
InChIKey
RVPBBFKWSJLAPD-UHFFFAOYSA-N
InChI
InChI=1S/C7H6FNO3/c1-12-7-5(8)3-2-4-6(7)9(10)11/h2-4H,1H3

Weigh it out

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

Work with 2-Fluoro-6-nitroanisole

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-methoxybenzene437-82-161 % similar 1,2-Difluoro-3-nitrobenzene6921-22-860 % similar 1-Fluoro-2-methyl-3-nitrobenzene769-10-859 % similar 1-Fluoro-2-nitrobenzene1493-27-259 % similar 4-Bromo-2-fluoro-6-nitroanisole74266-66-359 % similar 2-Chloro-1-fluoro-3-nitrobenzene21397-07-957 % similar 2-Fluoro-6-nitrophenol1526-17-655 % similar 2-Fluoro-6-nitrobenzenamine17809-36-855 % 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 4-Fluoro-3-nitroanisole61324-93-4 2-Fluoro-6-methoxynitrobenzene641-49-6 5-Fluoro-4-methyl-2-nitrophenol83341-28-0 5-Fluoro-2-methoxynicotinic acid884494-82-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook