8-methyl-decahydroquinoline

• ChemBase ID: 263485
• Molecular Formular: C10H19N
• Molecular Mass: 153.26456
• Monoisotopic Mass: 153.15174961
• SMILES: C12NCCCC1CCCC2C
• Canonical SMILES: CC1CCCC2C1NCCC2
• InChI: InChI=1S/C10H19N/c1-8-4-2-5-9-6-3-7-11-10(8)9/h8-11H,2-7H2,1H3
• InChIKey: UUNKAGONMZHCIP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 8-methyl-decahydroquinoline
• IUPAC Traditional name: 8-methyl-decahydroquinoline
• Synonyms: 8-methyl-decahydroquinoline

Database IDs

• MDL Number: MFCD09941178
• PubChem SID: 164319395
• PubChem CID: 5250725

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.9309728
• LogD (pH = 7.4): -0.71068716
• Log P: 2.3073735
• Molar Refractivity: 47.5202 cm^3
• Polarizability: 19.244478 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.886

Product Information

• Purity: 95%