guanidine hydrobromide

• ChemBase ID: 169790
• Molecular Formular: CH6BrN3
• Molecular Mass: 139.98244
• Monoisotopic Mass: 138.97450921
• SMILES: NC(=N)N.Br
• Canonical SMILES: NC(=N)N.Br
• InChI: InChI=1S/CH5N3.BrH/c2-1(3)4;/h(H5,2,3,4);1H
• InChIKey: VQNVZLDDLJBKNS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: guanidine hydrobromide
• IUPAC Traditional name: guanidine hydrobromide
• Synonyms: Guanidine Monohydrobromide; Guanidinium Bromide; Guanidine Hydrobromide

Database IDs

• CAS Number: 19244-98-5
• PubChem SID: 162263922
• PubChem CID: 71282

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 3
• LogD (pH = 5.5): -3.6522877
• LogD (pH = 7.4): -3.6514976
• Log P: -1.236839
• Molar Refractivity: 25.8588 cm^3
• Polarizability: 5.61125 Å^3
• Polar Surface Area: 75.89 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

DETAILS

Toronto Research Chemicals - G821230

Guanidine has a good bacterial and fungicidal efficacy when used in low concentration and can also be used as disinfectant.

REFERENCES

• Laemmli, U., et al.: Nature, 227, 680 (1970)
• Nissen, N., et al.: Biochem. J., 338, 637 (1970)
• Gibson, C., et al.: Circulation, 101, 125 (1970)