2-(cyclohexylmethyl)morpholine

• ChemBase ID: 796920
• Molecular Formular: C11H21NO
• Molecular Mass: 183.29054
• Monoisotopic Mass: 183.1623143
• SMILES: C1C(OCCN1)CC1CCCCC1
• Canonical SMILES: C1CCC(CC1)CC1CNCCO1
• InChI: InChI=1S/C11H21NO/c1-2-4-10(5-3-1)8-11-9-12-6-7-13-11/h10-12H,1-9H2
• InChIKey: BXLBFBYACGPOLN-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(cyclohexylmethyl)morpholine
• IUPAC Traditional name: 2-(cyclohexylmethyl)morpholine
• Synonyms: 2-(CyclohexylMethyl)Morpholine

Database IDs

• CAS Number: 927801-18-1

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.74508345
• LogD (pH = 7.4): 0.89071846
• Log P: 2.1292863
• Molar Refractivity: 53.8611 cm^3
• Polarizability: 21.75466 Å^3
• Polar Surface Area: 21.26 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 97%