3-Fluoro-4-nitrobenzaldehyde

C₇H₄FNO₃CAS 160538-51-2169.11 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Nitro

Properties

Molecular formula: C₇H₄FNO₃
Molar mass: 169.11 g/mol
Exact mass: 169.0175 Da
logP: 1.55Crippen estimate
Polar surface area: 60.2 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

160538-51-2

SMILES

C1=CC(=C(C=C1C=O)F)[N+](=O)[O-]

InChIKey

BWUIGISQVCIQBT-UHFFFAOYSA-N

InChI

InChI=1S/C7H4FNO3/c8-6-3-5(4-10)1-2-7(6)9(11)12/h1-4H

Weigh it out

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

Names and synonyms

1 names

3-Fluoro-4-nitro-benzaldehyde

Work with 3-Fluoro-4-nitrobenzaldehyde

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

2,4-Difluoronitrobenzene446-35-565 % similar 3-Hydroxy-4-nitrobenzaldehyde704-13-264 % similar 4-Bromo-3-nitrobenzaldehyde163596-75-658 % similar 4-Chloro-3-nitrobenzaldehyde16588-34-458 % similar 4-Hydroxy-3-nitrobenzaldehyde3011-34-558 % similar 4-Methyl-3-nitrobenzaldehyde31680-07-658 % similar 3-Fluoro-4-nitrobenzenamine2369-13-357 % similar 4-Bromo-2-fluoro-1-nitrobenzene321-23-357 % similar

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

Same formula

2-Fluoro-4-nitrobenzaldehyde157701-72-9 2-Fluoro-5-nitrobenzaldehyde27996-87-8 4-Fluoro-2-nitrobenzaldehyde2923-96-8 5-Fluoro-2-nitrobenzaldehyde395-81-3

Elsewhere

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