{2-[ethyl(methyl)amino]ethyl}(methyl)amine

• ChemBase ID: 308124
• Molecular Formular: C6H16N2
• Molecular Mass: 116.20464
• Monoisotopic Mass: 116.13134852
• SMILES: N(CCNC)(CC)C
• Canonical SMILES: CNCCN(CC)C
• InChI: InChI=1S/C6H16N2/c1-4-8(3)6-5-7-2/h7H,4-6H2,1-3H3
• InChIKey: KQNNOGJHLWDFHO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {2-[ethyl(methyl)amino]ethyl}(methyl)amine
• IUPAC Traditional name: {2-[ethyl(methyl)amino]ethyl}(methyl)amine
• Synonyms: N-ethyl-N,N'-dimethyl-1,2-ethanediamine

Database IDs

• CAS Number: 98279-30-2
• MDL Number: MFCD11505283

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -4.348139
• LogD (pH = 7.4): -2.4048178
• Log P: 0.182574
• Molar Refractivity: 37.4611 cm^3
• Polarizability: 14.858968 Å^3
• Polar Surface Area: 15.27 Å^2