3-methoxypropanimidamide

• ChemBase ID: 307226
• Molecular Formular: C4H10N2O
• Molecular Mass: 102.135
• Monoisotopic Mass: 102.07931295
• SMILES: C(=N)(CCOC)N
• Canonical SMILES: COCCC(=N)N
• InChI: InChI=1S/C4H10N2O/c1-7-3-2-4(5)6/h2-3H2,1H3,(H3,5,6)
• InChIKey: GOLODWMXGLKPFT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 3-methoxypropanimidamide
• IUPAC Traditional name: 3-methoxypropanimidamide
• Synonyms: 3-methoxypropanimidamide

Database IDs

• CAS Number: 736905-51-4
• MDL Number: MFCD05663317

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -3.3130102
• LogD (pH = 7.4): -3.3116343
• Log P: -0.89756894
• Molar Refractivity: 38.2128 cm^3
• Polarizability: 10.669806 Å^3
• Polar Surface Area: 59.1 Å^2