chempirical

4-Methyl-1H-imidazole-5-methanol hydrochloride

C5H9ClN2OCAS 38585-62-5148.59 g/mol

Open in Covalent MOL file
NHNHOHCl
Alcohol

Properties

Molecular formula
C5H9ClN2O
Molar mass
148.59 g/mol
Exact mass
148.0403 Da
logP
0.63Crippen estimate
Polar surface area
48.9 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
38585-62-5
SMILES
Cc1nc[nH]c1CO.Cl
InChIKey
UBHDUFNPQJWPRQ-UHFFFAOYSA-N
InChI
InChI=1S/C5H8N2O.ClH/c1-4-5(2-8)7-3-6-4;/h3,8H,2H2,1H3,(H,6,7);1H

Weigh it out

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

Names and synonyms

7 names
  • 1H-Imidazole-5-methanol, 4-methyl-, hydrochloride (1:1)
  • 4-Methyl-5-imidazolemethanol hydrochloride
  • (4-Methyl-1H-imidazol-5-yl)methanol hydrochloride
  • (5-Methyl-1H-imidazol-4-yl)methanol hydrochloride
  • 1H-Imidazole-4-methanol, 5-methyl-, monohydrochloride
  • 4-(Hydroxymethyl)-5-methylimidazole hydrochloride
  • 5-Methyl-4-imidazolemethanol hydrochloride

Work with 4-Methyl-1H-imidazole-5-methanol 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

4-(Hydroxymethyl)-5-methylimidazole29636-87-188 % similar 4-Deoxypyridoxine148-51-640 % similar 4-(Hydroxymethyl)imidazole hydrochloride32673-41-940 % similar Pyritinol hydrochloride10049-83-936 % similar 4-(Aminomethyl)-5-hydroxy-6-methyl-3-pyridinemethanol dihydrochloride524-36-736 % similar Cimetidine hydrochloride70059-30-236 % similar 2-Methyl-3-hydroxy-4-formyl-5-hydroxymethylpyridine hydrochloride65-22-536 % similar Alosetron hydrochloride122852-69-134 % similar

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

Elsewhere

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