chempirical

Methylguanidine hydrochloride

C2H8ClN3CAS 22661-87-6109.56 g/mol

Open in Covalent MOL file
NHNHNH2HCl
Guanidine

Properties

Molecular formula
C2H8ClN3
Molar mass
109.56 g/mol
Exact mass
109.0407 Da
logP
-0.48Crippen estimate
Polar surface area
61.9 Ų
H-bond donors / acceptors
3 / 1
Rotatable bonds
0

Identifiers

CAS number
22661-87-6
SMILES
CNC(=N)N.Cl
InChIKey
VJQCNCOGZPSOQZ-UHFFFAOYSA-N
InChI
InChI=1S/C2H7N3.ClH/c1-5-2(3)4;/h1H3,(H4,3,4,5);1H

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Names and synonyms

1 names
  • Guanidine, methyl-, hydrochloride

Work with Methylguanidine 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

Aminoguanidine hydrochloride16139-18-755 % similar Aminoguanidinium chloride1937-19-555 % similar Metformin hydrochloride1115-70-446 % similar Dodecylguanidine hydrochloride13590-97-143 % similar Guanidinium chloride50-01-138 % similar Metformin657-24-936 % similar Moroxydine hydrochloride3160-91-635 % similar 2,2-Dimethylpropionamidine hydrochloride18202-73-835 % similar

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

Same formula

1-Methylguanidine hydrochloride21770-81-0

Elsewhere

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