benzyl(methoxy)amine

• ChemBase ID: 248541
• Molecular Formular: C8H11NO
• Molecular Mass: 137.17904
• Monoisotopic Mass: 137.08406398
• SMILES: N(OC)Cc1ccccc1
• Canonical SMILES: CONCc1ccccc1
• InChI: InChI=1S/C8H11NO/c1-10-9-7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
• InChIKey: QWLISCJHYITNQF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: benzyl(methoxy)amine
• IUPAC Traditional name: benzyl(methoxy)amine
• Synonyms: benzyl(methoxy)amine

Database IDs

• MDL Number: MFCD21100694
• PubChem SID: 164304451
• PubChem CID: 11815413

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 1.5268548
• LogD (pH = 7.4): 1.584822
• Log P: 1.5856135
• Molar Refractivity: 51.2711 cm^3
• Polarizability: 16.237978 Å^3
• Polar Surface Area: 21.26 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.471

Product Information

• Purity: 95%