octahydroindolizin-2-amine

• ChemBase ID: 274471
• Molecular Formular: C8H16N2
• Molecular Mass: 140.22604
• Monoisotopic Mass: 140.13134852
• SMILES: N12C(CC(C1)N)CCCC2
• Canonical SMILES: NC1CC2N(C1)CCCC2
• InChI: InChI=1S/C8H16N2/c9-7-5-8-3-1-2-4-10(8)6-7/h7-8H,1-6,9H2
• InChIKey: DNWGGLVQANNAHV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: octahydroindolizin-2-amine
• IUPAC Traditional name: octahydroindolizin-2-amine
• Synonyms: octahydroindolizin-2-amine

Database IDs

• MDL Number: MFCD18838826
• PubChem SID: 164330381
• PubChem CID: 54593182

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -5.04908
• LogD (pH = 7.4): -3.1963305
• Log P: 0.25152072
• Molar Refractivity: 42.3167 cm^3
• Polarizability: 17.072641 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.477

Product Information

• Purity: 95%