(3-aminopropyl)(2-methoxyethyl)methylamine

• ChemBase ID: 257340
• Molecular Formular: C7H18N2O
• Molecular Mass: 146.23062
• Monoisotopic Mass: 146.14191321
• SMILES: N(CCCN)(CCOC)C
• Canonical SMILES: NCCCN(CCOC)C
• InChI: InChI=1S/C7H18N2O/c1-9(5-3-4-8)6-7-10-2/h3-8H2,1-2H3
• InChIKey: HKXOLSWLDQZOTG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3-aminopropyl)(2-methoxyethyl)methylamine
• IUPAC Traditional name: (3-aminopropyl)(2-methoxyethyl)methylamine
• Synonyms: N-(2-methoxyethyl)-N-methylpropane-1,3-diamine

Database IDs

• MDL Number: MFCD11505397
• PubChem SID: 164313250
• PubChem CID: 28387859

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -6.196963
• LogD (pH = 7.4): -3.997817
• Log P: -0.5938301
• Molar Refractivity: 43.8468 cm^3
• Polarizability: 17.369604 Å^3
• Polar Surface Area: 38.49 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.178

Product Information

• Purity: 95%