chempirical

2,4-Diaminophenoxyethanol dihydrochloride

C8H14Cl2N2O2CAS 66422-95-5241.11 g/mol

Open in Covalent MOL file
HClHClH2NOOHNH2
AlcoholEtherPrimary amine

Properties

Molecular formula
C8H14Cl2N2O2
Molar mass
241.11 g/mol
Exact mass
240.0432 Da
logP
1.07Crippen estimate
Polar surface area
81.5 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
3

Identifiers

CAS number
66422-95-5
SMILES
Cl.Cl.Nc1ccc(OCCO)c(N)c1
InChIKey
VXYWXJXCQSDNHX-UHFFFAOYSA-N
InChI
InChI=1S/C8H12N2O2.2ClH/c9-6-1-2-8(7(10)5-6)12-4-3-11;;/h1-2,5,11H,3-4,9-10H2;2*1H

Weigh it out

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

Names and synonyms

5 names
  • Ethanol, 2-(2,4-diaminophenoxy)-, hydrochloride (1:2)
  • Ethanol, 2-(2,4-diaminophenoxy)-, dihydrochloride
  • 2-(2,4-Diaminophenoxy)ethanol dihydrochloride
  • 2,4-Diamino-1-(2-hydroxyethoxy)benzene dihydrochloride
  • 4-2-Hydroxyethoxy-1,3-Benzenediamine dihydrochloride

Work with 2,4-Diaminophenoxyethanol dihydrochloride

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

1,3-Bis(2,4-diaminophenoxy)propane tetrahydrochloride74918-21-174 % similar 1,3-Diamino-4-(2-hydroxyethoxy)benzene sulfate70643-20-872 % similar 1,3-Bis(2,4-diaminophenoxy)propane81892-72-065 % similar 2,4-Diaminoanisole dihydrochloride614-94-856 % similar 4-Aminobenzo-15-crown-5 hydrochloride111076-66-553 % similar 2,4-Diamino phenetole sulfate68015-98-550 % similar 1,4-Benzodioxan-6-amine22013-33-849 % similar 2,4-Diaminoanisole615-05-447 % similar

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

Same formula

4-(Aminomethyl)-5-hydroxy-6-methyl-3-pyridinemethanol dihydrochloride524-36-7

Elsewhere

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