tert-butyl(2-methylpropyl)amine

• ChemBase ID: 308365
• Molecular Formular: C8H19N
• Molecular Mass: 129.24316
• Monoisotopic Mass: 129.15174961
• SMILES: N(C(C)(C)C)CC(C)C
• Canonical SMILES: CC(CNC(C)(C)C)C
• InChI: InChI=1S/C8H19N/c1-7(2)6-9-8(3,4)5/h7,9H,6H2,1-5H3
• InChIKey: KVYFSZGMVJSHDS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: tert-butyl(2-methylpropyl)amine
• IUPAC Traditional name: tert-butyl(2-methylpropyl)amine
• Synonyms: N-(tert-butyl)-2-methyl-1-propanamine

Database IDs

• MDL Number: MFCD09044552

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -1.1338991
• LogD (pH = 7.4): -0.95989925
• Log P: 2.1053843
• Molar Refractivity: 42.2432 cm^3
• Polarizability: 17.036163 Å^3
• Polar Surface Area: 12.03 Å^2