chempirical

1-Methyl-1H-imidazol-4-amine hydrochloride

C4H8ClN3CAS 89088-69-7133.58 g/mol

Open in Covalent MOL file
NNNH2HCl
Primary amine

Properties

Molecular formula
C4H8ClN3
Molar mass
133.58 g/mol
Exact mass
133.0407 Da
logP
0.42Crippen estimate
Polar surface area
43.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

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
89088-69-7
SMILES
CN1C=C(N=C1)N.Cl
InChIKey
STHPSKXDPYIGLM-UHFFFAOYSA-N
InChI
InChI=1S/C4H7N3.ClH/c1-7-2-4(5)6-3-7;/h2-3H,5H2,1H3;1H

Weigh it out

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Work with 1-Methyl-1H-imidazol-4-amine 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

(1-Methyl-1H-imidazol-4-yl)methanamine486414-83-944 % similar 4-Bromo-1-methyl-1H-imidazole25676-75-943 % similar 4-Iodo-1-methyl-1H-imidazole71759-87-043 % similar 1-Methyl-1H-imidazole-4-carbaldehyde17289-26-839 % similar 1-Methyl-1H-imidazole-4-carbonitrile66121-69-539 % similar 1-Methyl-1H-imidazole-4-sulfonyl chloride137049-00-436 % similar 1-Methyl-4-nitroimidazole3034-41-136 % similar 1-Methyl-1H-imidazole-4-carboxylic acid41716-18-136 % similar

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

Elsewhere

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