1H-Imidazol-2-ylmethylamine dihydrochloride

C₄H₉Cl₂N₃CAS 22600-77-7170.04 g/mol

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Properties

Molecular formula: C₄H₉Cl₂N₃
Molar mass: 170.04 g/mol
Exact mass: 169.0174 Da
logP: 0.71Crippen estimate
Polar surface area: 54.7 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

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

22600-77-7

SMILES

C1=CN=C(N1)CN.Cl.Cl

InChIKey

KYUDBQDDNKPSIC-UHFFFAOYSA-N

InChI

InChI=1S/C4H7N3.2ClH/c5-3-4-6-1-2-7-4;;/h1-2H,3,5H2,(H,6,7);2*1H

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Names and synonyms

1 names

1H-Imidazol-2-ylmethanamine dihydrochloride

Work with 1H-Imidazol-2-ylmethylamine 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

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.

1H-Imidazole-2-methanamine53332-80-2Free base

Similar compounds

2-Ethylimidazole1072-62-448 % similar 1H-Imidazole-2-methanol3724-26-348 % similar 2-Propylimidazole50995-95-445 % similar 2-Aminomethylpyrimidine hydrochloride372118-67-743 % similar 2-Fluoro-1H-imidazole hydrochloride42309-92-243 % similar 2-Butyl-1H-imidazole50790-93-742 % similar 2-Undecylimidazole16731-68-340 % similar 2-Heptadecylimidazole23328-87-240 % similar

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

Elsewhere

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