(1-cyclopropylethyl)(2-methoxyethyl)amine

• ChemBase ID: 259147
• Molecular Formular: C8H17NO
• Molecular Mass: 143.22668
• Monoisotopic Mass: 143.13101417
• SMILES: C1(CC1)C(NCCOC)C
• Canonical SMILES: COCCNC(C1CC1)C
• InChI: InChI=1S/C8H17NO/c1-7(8-3-4-8)9-5-6-10-2/h7-9H,3-6H2,1-2H3
• InChIKey: DZQPYJXLRGGDKY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (1-cyclopropylethyl)(2-methoxyethyl)amine
• IUPAC Traditional name: (1-cyclopropylethyl)(2-methoxyethyl)amine
• Synonyms: (1-cyclopropylethyl)(2-methoxyethyl)amine

Database IDs

• MDL Number: MFCD11139373
• PubChem SID: 164315057
• PubChem CID: 43190130

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.2628152
• LogD (pH = 7.4): -1.5771328
• Log P: 0.95729834
• Molar Refractivity: 42.0977 cm^3
• Polarizability: 16.955612 Å^3
• Polar Surface Area: 21.26 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.914

Product Information

• Purity: 95%