6-Amino-2,4-dichloro-3-ethylphenol hydrochloride

C8H10Cl3NOCAS 101819-99-2242.52 g/mol

Open in Covalent MOL file
ClNH2OHClHCl
Aryl halidePhenolPrimary amine

Properties

Molecular formula
C8H10Cl3NO
Molar mass
242.52 g/mol
Exact mass
240.9828 Da
logP
3.27Crippen estimate
Polar surface area
46.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
101819-99-2
SMILES
CCc1c(Cl)cc(N)c(O)c1Cl.Cl
InChIKey
XZZITYVICUAZNB-UHFFFAOYSA-N
InChI
InChI=1S/C8H9Cl2NO.ClH/c1-2-4-5(9)3-6(11)8(12)7(4)10;/h3,12H,2,11H2,1H3;1H

Weigh it out

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Names and synonyms

4 names
  • Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride (1:1)
  • Phenol, 6-amino-2,4-dichloro-3-ethyl-, hydrochloride
  • 2-Amino-4,6-dichloro-5-ethylphenol hydrochloride
  • 2,4-Dichloro-3-ethyl-6-aminophenol hydrochloride

Work with 6-Amino-2,4-dichloro-3-ethylphenol hydrochloride

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

6-Amino-2,4-dichloro-m-cresol hydrochloride39549-31-062 % similar 6-Amino-2,4-dichloro-3-methylphenol40677-44-954 % similar 2,4-Dichloro-3-ethyl-6-nitrophenol99817-36-450 % similar 2-Amino-4,6-dichlorophenol527-62-840 % similar 2-Amino-6-chlorophenol38191-33-238 % similar 4-Amino-3-chlorophenol hydrochloride52671-64-438 % similar Hexachlorophene70-30-437 % similar o-Chloroaniline hydrochloride137-04-236 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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