chempirical

4-Amino-2,6-dichlorophenol

C6H5Cl2NOCAS 5930-28-9178.01 g/mol

Open in Covalent MOL file
H2NClOHCl
Aryl halidePhenolPrimary amine

Properties

Molecular formula
C6H5Cl2NO
Molar mass
178.01 g/mol
Exact mass
176.9748 Da
Melting point
168 °C
logP
2.28Crippen estimate
Polar surface area
46.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
5930-28-9
SMILES
Nc1cc(Cl)c(O)c(Cl)c1
InChIKey
KGEXISHTCZHGFT-UHFFFAOYSA-N
InChI
InChI=1S/C6H5Cl2NO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H,9H2

Weigh it out

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

Names and synonyms

6 names
  • Phenol, 4-amino-2,6-dichloro-
  • 2,6-Dichloro-4-aminophenol
  • 2,6-Dichloro-p-aminophenol
  • 3,5-Dichloro-4-hydroxyaniline
  • NSC 156835
  • 4-Hydroxy-3,5-dichloroaniline

Work with 4-Amino-2,6-dichlorophenol

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-Dichloro-1,4-benzenediamine609-20-157 % similar 3,4,5-Trichloroaniline634-91-357 % similar 2,4,6-Trichlorophenol88-06-257 % similar 2,6-Dichloro-4-methylphenol2432-12-454 % similar 3,5-Dichloro-4-fluorobenzenamine2729-34-252 % similar 4-Bromo-2,6-dichlorophenol3217-15-052 % similar 2,6-Dichloro-4-fluorophenol392-71-252 % similar 4-Amino-2-chlorophenol3964-52-152 % similar

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

Same formula

2,6-Dichloro-4-pyridinemethanol101990-69-6 Nicotinic acid chloride hydrochloride20260-53-1 Isonicotinoyl chloride hydrochloride39178-35-3 2-Amino-4,6-dichlorophenol527-62-8 (5,6-Dichloropyridin-3-yl)methanol54127-30-9

Elsewhere

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