[1-(ethoxymethyl)cyclobutyl]methanamine

• ChemBase ID: 307992
• Molecular Formular: C8H17NO
• Molecular Mass: 143.22668
• Monoisotopic Mass: 143.13101417
• SMILES: C1(CN)(COCC)CCC1
• Canonical SMILES: CCOCC1(CN)CCC1
• InChI: InChI=1S/C8H17NO/c1-2-10-7-8(6-9)4-3-5-8/h2-7,9H2,1H3
• InChIKey: KOZYXAZYCPPPGI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [1-(ethoxymethyl)cyclobutyl]methanamine
• IUPAC Traditional name: [1-(ethoxymethyl)cyclobutyl]methanamine
• Synonyms: 1-[1-(ethoxymethyl)cyclobutyl]methanamine

Database IDs

• CAS Number: 1015846-34-0
• MDL Number: MFCD09971228

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.3152049
• LogD (pH = 7.4): -1.6431729
• Log P: 0.69685125
• Molar Refractivity: 42.1344 cm^3
• Polarizability: 16.955612 Å^3
• Polar Surface Area: 35.25 Å^2