2-Chloro-1-fluoro-3-nitrobenzene

C₆H₃ClFNO₂CAS 21397-07-9175.54 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₆H₃ClFNO₂
Molar mass: 175.54 g/mol
Exact mass: 174.9836 Da
Boiling point: 237–239 °C
logP: 2.39Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

21397-07-9

SMILES

O=[N+]([O-])c1cccc(F)c1Cl

InChIKey

NJZSQTMICFLABM-UHFFFAOYSA-N

InChI

InChI=1S/C6H3ClFNO2/c7-6-4(8)2-1-3-5(6)9(10)11/h1-3H

Weigh it out

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

Names and synonyms

2 names

Benzene, 2-chloro-1-fluoro-3-nitro-
2-Chloro-3-fluoronitrobenzene

Work with 2-Chloro-1-fluoro-3-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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Same formula

1-Chloro-2-fluoro-3-nitrobenzene2106-49-2 2-Chloro-4-fluoro-1-nitrobenzene2106-50-5 1-Chloro-4-fluoro-2-nitrobenzene345-17-5 4-Chloro-1-fluoro-2-nitrobenzene345-18-6 3-Chloro-4-fluoronitrobenzene350-30-1 1-Chloro-2-fluoro-4-nitrobenzene350-31-2 2-Chloro-5-fluoronicotinic acid38186-88-8 1-Chloro-3-fluoro-2-nitrobenzene64182-61-2

Elsewhere

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