1-(methoxymethyl)-N-methylcyclopropan-1-amine

• ChemBase ID: 308253
• Molecular Formular: C6H13NO
• Molecular Mass: 115.17352
• Monoisotopic Mass: 115.09971404
• SMILES: C1(CC1)(NC)COC
• Canonical SMILES: COCC1(NC)CC1
• InChI: InChI=1S/C6H13NO/c1-7-6(3-4-6)5-8-2/h7H,3-5H2,1-2H3
• InChIKey: DAUXMNIXOMZOFC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(methoxymethyl)-N-methylcyclopropan-1-amine
• IUPAC Traditional name: 1-(methoxymethyl)-N-methylcyclopropan-1-amine
• Synonyms: 1-(methoxymethyl)-N-methylcyclopropanamine

Database IDs

• CAS Number: 1094071-97-2
• MDL Number: MFCD11053941

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.016415
• LogD (pH = 7.4): -1.8860229
• Log P: 0.14947927
• Molar Refractivity: 32.8377 cm^3
• Polarizability: 13.269628 Å^3
• Polar Surface Area: 21.26 Å^2