chempirical

2,4-Diaminophenoxyethanol

C8H12N2O2CAS 70643-19-5168.20 g/mol

Open in Covalent MOL file
H2NNH2OOH
AlcoholEtherPrimary amine

Properties

Molecular formula
C8H12N2O2
Molar mass
168.20 g/mol
Exact mass
168.0899 Da
logP
0.22Crippen estimate
Polar surface area
81.5 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
70643-19-5
SMILES
C1=CC(=C(C=C1N)N)OCCO
InChIKey
WCPGNFONICRLCL-UHFFFAOYSA-N
InChI
InChI=1S/C8H12N2O2/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5,11H,3-4,9-10H2

Weigh it out

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

Names and synonyms

1 names
  • 2-(2,4-Diaminophenoxy)ethanol

Work with 2,4-Diaminophenoxyethanol

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

1,3-Diamino-4-(2-hydroxyethoxy)benzene sulfate70643-20-8Salt 2,4-Diaminophenoxyethanol dihydrochloride66422-95-5Salt

Similar compounds

1,3-Bis(2,4-diaminophenoxy)propane81892-72-071 % similar 1,3-Bis(2,4-diaminophenoxy)propane tetrahydrochloride74918-21-165 % similar 2,4-Diamino phenetole sulfate68015-98-554 % similar 1,4-Benzodioxan-6-amine22013-33-853 % similar 2,4-Diaminoanisole615-05-452 % similar 2,3-Dihydro-1-benzofuran-5-amine42933-43-749 % similar 4'-Aminobenzo-15-crown-5-ether60835-71-449 % similar 2,4-Diaminoanisole dihydrochloride614-94-847 % similar

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

Same formula

1-Methyl-3-propyl-1H-pyrazole-5-carboxylic acid139755-99-0 N,N'-Ethylenebisacrylamide2956-58-3 2,5-Pyrazinediethanol4744-51-8 1-(tert-Butoxycarbonyl)imidazole49761-82-2 1,3-Dimethyl-5-ethoxycarbonylpyrazole5744-40-1 Ethyl 1,5-dimethyl-1H-pyrazole-3-carboxylate5744-51-4 1,3-Diazaspiro[4.5]decane-2,4-dione702-62-5 Hexamethylene diisocyanate822-06-0

Elsewhere

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