4-(cyclopent-2-en-1-yl)morpholine

• ChemBase ID: 285136
• Molecular Formular: C9H15NO
• Molecular Mass: 153.2215
• Monoisotopic Mass: 153.11536411
• SMILES: N1(C2C=CCC2)CCOCC1
• Canonical SMILES: O1CCN(CC1)C1C=CCC1
• InChI: InChI=1S/C9H15NO/c1-2-4-9(3-1)10-5-7-11-8-6-10/h1,3,9H,2,4-8H2
• InChIKey: WOSAZVLZARYJIY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-(cyclopent-2-en-1-yl)morpholine
• IUPAC Traditional name: 4-(cyclopent-2-en-1-yl)morpholine
• Synonyms: 4-(cyclopent-2-en-1-yl)morpholine

Database IDs

• MDL Number: MFCD21602498
• PubChem SID: 180670667
• PubChem CID: 222022

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -0.86925226
• LogD (pH = 7.4): 0.7673429
• Log P: 1.1203567
• Molar Refractivity: 46.4384 cm^3
• Polarizability: 17.8278 Å^3
• Polar Surface Area: 12.47 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.146

Product Information

• Purity: 95%