4-Chloro-3-nitrophenol

C₆H₄ClNO₃CAS 610-78-6173.55 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: 126.5 °C
logP: 1.95Crippen estimate
Polar surface area: 63.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

610-78-6

SMILES

O=[N+]([O-])c1cc(O)ccc1Cl

InChIKey

JUIKCULGDIZNDI-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

4 names

Phenol, 4-chloro-3-nitro-
3-Nitro-4-chlorophenol
2-Chloro-5-hydroxynitrobenzene
NSC 211001

Work with 4-Chloro-3-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

4-Bromo-1-chloro-2-nitrobenzene16588-24-265 % similar 1,4-Dichloro-2-nitrobenzene89-61-264 % similar 2,4-Dinitrochlorobenzene97-00-764 % similar 1-Chloro-4-fluoro-2-nitrobenzene345-17-562 % similar 4-Methyl-3-nitrophenol2042-14-060 % similar 4-Amino-3-nitrophenol610-81-160 % similar 4-Chloro-3-nitroaniline635-22-360 % similar 4-Chloro-3-nitrotoluene89-60-160 % similar

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

Same formula

2-Chloro-6-nitrophenol603-86-1 Nitrofungin619-08-9 2-Chloro-5-nitrophenol619-10-3 4-Chloro-2-nitrophenol89-64-5

Elsewhere

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