spiro[3.5]nonan-7-ylmethanamine

• ChemBase ID: 289857
• Molecular Formular: C10H19N
• Molecular Mass: 153.26456
• Monoisotopic Mass: 153.15174961
• SMILES: NCC1CCC2(CC1)CCC2
• Canonical SMILES: NCC1CCC2(CC1)CCC2
• InChI: InChI=1S/C10H19N/c11-8-9-2-6-10(7-3-9)4-1-5-10/h9H,1-8,11H2
• InChIKey: OPYDFKJFDKKDIO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: spiro[3.5]nonan-7-ylmethanamine
• IUPAC Traditional name: spiro[3.5]nonan-7-ylmethanamine
• Synonyms: Spiro[3.5]nonan-7-ylmethanamine

Database IDs

• CAS Number: 877125-98-9
• PubChem SID: 180675388
• PubChem CID: 50998994

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.96755576
• LogD (pH = 7.4): -0.55663514
• Log P: 2.0567334
• Molar Refractivity: 47.4863 cm^3
• Polarizability: 19.244478 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%