2,4,5,6-Tetraaminopyrimidine hydrochloride

C4H9ClN6CAS 39944-62-2176.61 g/mol

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HClHNHNNH2NH2NHHN
Primary amine

Properties

Molecular formula
C4H9ClN6
Molar mass
176.61 g/mol
Exact mass
176.0577 Da
logP
-1.11Crippen estimate
Polar surface area
131.3 Ų
H-bond donors / acceptors
6 / 4
Rotatable bonds
0

Hazards

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

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Identifiers

CAS number
39944-62-2
SMILES
Cl.N=c1[nH]c(N)c(N)c(=N)[nH]1
InChIKey
AGTIQJILUCODGM-UHFFFAOYSA-N
InChI
InChI=1S/C4H8N6.ClH/c5-1-2(6)9-4(8)10-3(1)7;/h5H2,(H6,6,7,8,9,10);1H

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Names and synonyms

2 names
  • 2,4,5,6-Pyrimidinetetramine, hydrochloride (1:?)
  • Pyrimidinetetramine, hydrochloride

Work with 2,4,5,6-Tetraaminopyrimidine 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

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.

Tetraaminopyrimidine1004-74-6Free base Tetraaminopyrimidine sulfate5392-28-9Salt 2,4,5,6-Tetraaminopyrimidine sulfate49647-58-7Salt

Similar compounds

5-Nitroso-2,4,6-pyrimidinetriamine1006-23-147 % similar 2,6-Diaminopurine1904-98-935 % similar 4-Hydroxy-2,5,6-triaminopyrimidine1004-75-732 % similar Melamine108-78-132 % similar 2,5-Diamino-4,6-dihydroxypyrimidine hydrochloride56830-58-130 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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