5-methylfuran-2-carboximidamide

• ChemBase ID: 309537
• Molecular Formular: C6H8N2O
• Molecular Mass: 124.14052
• Monoisotopic Mass: 124.06366289
• SMILES: c1(oc(cc1)C)C(=N)N
• Canonical SMILES: Cc1ccc(o1)C(=N)N
• InChI: InChI=1S/C6H8N2O/c1-4-2-3-5(9-4)6(7)8/h2-3H,1H3,(H3,7,8)
• InChIKey: UZRQNAJRDUVHBX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5-methylfuran-2-carboximidamide
• IUPAC Traditional name: 5-methylfuran-2-carboximidamide
• Synonyms: 5-methyl-2-furancarboximidamide

Database IDs

• CAS Number: 856290-28-3
• MDL Number: MFCD09751984

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -1.8696202
• LogD (pH = 7.4): -0.3494821
• Log P: 0.15352225
• Molar Refractivity: 45.2711 cm^3
• Polarizability: 12.669707 Å^3
• Polar Surface Area: 63.01 Å^2