(2-aminobutyl)dimethylamine

• ChemBase ID: 307941
• Molecular Formular: C6H16N2
• Molecular Mass: 116.20464
• Monoisotopic Mass: 116.13134852
• SMILES: N(CC(N)CC)(C)C
• Canonical SMILES: CCC(CN(C)C)N
• InChI: InChI=1S/C6H16N2/c1-4-6(7)5-8(2)3/h6H,4-5,7H2,1-3H3
• InChIKey: AKRUIVSMWDCKNI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (2-aminobutyl)dimethylamine
• IUPAC Traditional name: (2-aminobutyl)dimethylamine
• Synonyms: (2-aminobutyl)dimethylamine

Database IDs

• CAS Number: 74247-34-0
• MDL Number: MFCD01740933

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.4287925
• LogD (pH = 7.4): -2.2085621
• Log P: 0.33228308
• Molar Refractivity: 36.8807 cm^3
• Polarizability: 14.858968 Å^3
• Polar Surface Area: 29.26 Å^2