2-Amino-4-chloro-6-nitrophenol

C₆H₅ClN₂O₃CAS 6358-08-3188.57 g/mol

Open in Covalent MOL file

Aryl halide Nitro Phenol Primary amine

Properties

Molecular formula: C₆H₅ClN₂O₃
Molar mass: 188.57 g/mol
Exact mass: 187.9989 Da
logP: 1.54Crippen estimate
Polar surface area: 89.4 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 1

Identifiers

CAS number

6358-08-3

SMILES

Nc1cc(Cl)cc([N+](=O)[O-])c1O

InChIKey

MHAFRUMLQZZSIN-UHFFFAOYSA-N

InChI

InChI=1S/C6H5ClN2O3/c7-3-1-4(8)6(10)5(2-3)9(11)12/h1-2,10H,8H2

Weigh it out

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

Names and synonyms

1 names

Phenol, 2-amino-4-chloro-6-nitro-

Work with 2-Amino-4-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

5,5′-Dichloro-3,3′-dinitro[1,1′-biphenyl]-2,2′-diol10331-57-469 % similar 2,4-Dichloro-6-nitrophenol609-89-267 % similar Picramic acid96-91-367 % similar 2-Amino-4-methyl-6-nitrophenol6265-07-263 % similar 5-Chloro-2-nitroaniline1635-61-659 % similar 4-Chloro-2-nitroaniline89-63-459 % similar 3-Amino-4-hydroxy-5-nitrobenzenesulfonic acid96-93-557 % similar 2-Hydroxy-5-chloro-3-nitroacetophenone84942-40-556 % similar

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

Same formula

2-Chloro-6-methoxy-3-nitropyridine38533-61-8 2-Amino-4-chloro-5-nitrophenol6358-07-2 2-Amino-6-chloro-4-nitrophenol6358-09-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook