2-Chloro-6-nitrophenol

C₆H₄ClNO₃CAS 603-86-1173.55 g/mol

Open in Covalent MOL file

Aryl halide Nitro Phenol

Properties

Molecular formula: C₆H₄ClNO₃
Molar mass: 173.55 g/mol
Exact mass: 172.9880 Da
Melting point: 70 °C
logP: 1.95Crippen estimate
Polar surface area: 63.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

603-86-1

SMILES

O=[N+]([O-])c1cccc(Cl)c1O

InChIKey

ICCYFVWQNFMENX-UHFFFAOYSA-N

InChI

InChI=1S/C6H4ClNO3/c7-4-2-1-3-5(6(4)9)8(10)11/h1-3,9H

Weigh it out

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

Names and synonyms

3 names

Phenol, 2-chloro-6-nitro-
6-Chloro-2-nitrophenol
NSC 28581

Work with 2-Chloro-6-nitrophenol

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

2,6-Dinitrophenol573-56-875 % similar 2-Nitrochlorobenzene88-73-367 % similar 2-Chloro-4,6-dinitrophenol946-31-667 % similar 2,4-Dichloro-6-nitrophenol609-89-265 % similar 2-Bromo-6-nitrophenol13073-25-164 % similar 2,3-Dichloronitrobenzene3209-22-163 % similar 2-Methyl-6-nitrophenol13073-29-562 % similar 2-Fluoro-6-nitrophenol1526-17-662 % similar

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

Same formula

4-Chloro-3-nitrophenol610-78-6 Nitrofungin619-08-9 2-Chloro-5-nitrophenol619-10-3 4-Chloro-2-nitrophenol89-64-5

Elsewhere

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