(1-methoxycyclobutyl)methanamine hydrochloride

• ChemBase ID: 248459
• Molecular Formular: C6H14ClNO
• Molecular Mass: 151.63446
• Monoisotopic Mass: 151.07639175
• SMILES: C1(OC)(CN)CCC1.Cl
• Canonical SMILES: NCC1(OC)CCC1.Cl
• InChI: InChI=1S/C6H13NO.ClH/c1-8-6(5-7)3-2-4-6;/h2-5,7H2,1H3;1H
• InChIKey: QHQBSICDAMCQJD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (1-methoxycyclobutyl)methanamine hydrochloride
• IUPAC Traditional name: (1-methoxycyclobutyl)methanamine hydrochloride
• Synonyms: (1-methoxycyclobutyl)methanamine hydrochloride

Database IDs

• PubChem SID: 164304369
• PubChem CID: 71758503

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.8302453
• LogD (pH = 7.4): -1.9228332
• Log P: 0.16146754
• Molar Refractivity: 32.6641 cm^3
• Polarizability: 13.269628 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.371

Product Information

• Purity: 95%