2-ethoxyethanimidamide

• ChemBase ID: 307625
• Molecular Formular: C4H10N2O
• Molecular Mass: 102.135
• Monoisotopic Mass: 102.07931295
• SMILES: C(=N)(N)COCC
• Canonical SMILES: CCOCC(=N)N
• InChI: InChI=1S/C4H10N2O/c1-2-7-3-4(5)6/h2-3H2,1H3,(H3,5,6)
• InChIKey: TXJURWDJHWXLSC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-ethoxyethanimidamide
• IUPAC Traditional name: 2-ethoxyethanimidamide
• Synonyms: 2-ethoxyethanimidamide

Database IDs

• CAS Number: 133915-12-5
• MDL Number: MFCD09055361

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -3.187992
• LogD (pH = 7.4): -2.9008112
• Log P: -0.77777374
• Molar Refractivity: 38.262 cm^3
• Polarizability: 10.669806 Å^3
• Polar Surface Area: 59.1 Å^2