hydrogen pyrazine-2-carboximidamide chloride

• ChemBase ID: 293544
• Molecular Formular: C5H6ClN4-
• Molecular Mass: 157.58094
• Monoisotopic Mass: 157.02809889
• SMILES: c1nccnc1C(=N)N.[Cl-]
• Canonical SMILES: NC(=N)c1cnccn1.[Cl-]
• InChI: InChI=1S/C5H6N4.ClH/c6-5(7)4-3-8-1-2-9-4;/h1-3H,(H3,6,7);1H/p-1
• InChIKey: FCVKLVNLBIBCCU-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: hydrogen pyrazine-2-carboximidamide chloride
• IUPAC Traditional name: hydrogen pyrazine-2-carboximidamide chloride
• Synonyms: Pyrazine-2-carboximidamide hydrochloride

Database IDs

• CAS Number: 138588-41-7
• MDL Number: MFCD05663360
• PubChem SID: 180679075
• PubChem CID: 73994944

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -2.989921
• LogD (pH = 7.4): -1.4858333
• Log P: -1.1557802
• Molar Refractivity: 43.0447 cm^3
• Polarizability: 12.249308 Å^3
• Polar Surface Area: 75.65 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%