1-(cyanosulfanyl)guanidine

• ChemBase ID: 106688
• Molecular Formular: C2H4N4S
• Molecular Mass: 116.14496
• Monoisotopic Mass: 116.01566715
• SMILES: NC(=N)NSC#N
• Canonical SMILES: NC(=N)NSC#N
• InChI: InChI=1S/C2H4N4S/c3-1-7-6-2(4)5/h(H4,4,5,6)
• InChIKey: FZPKSSRLAIBRQA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(cyanosulfanyl)guanidine
• IUPAC Traditional name: 1-(cyanosulfanyl)guanidine
• Synonyms: Guanidinium rhodanide; Guanidinium thiocyanate; GUANIDINE THIOCYANATE

Database IDs

• CAS Number: 593-84-0
• EC Number: 209-812-1
• PubChem SID: 162089089
• PubChem CID: 547739

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 3
• LogD (pH = 5.5): -2.7795687
• LogD (pH = 7.4): -2.3560655
• Log P: -0.37341458
• Molar Refractivity: 50.0007 cm^3
• Polarizability: 10.4317465 Å^3
• Polar Surface Area: 85.69 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: >98%

DETAILS

MP Biomedicals - 04820991

Research Grade
Purity: >98%
Strong protein denaturant which inactivates nucleases approximately 2.5 times faster than guanidine hydrochloride.