1,2,2-trimethylpiperazine

• ChemBase ID: 308123
• Molecular Formular: C7H16N2
• Molecular Mass: 128.21534
• Monoisotopic Mass: 128.13134852
• SMILES: N1(C(CNCC1)(C)C)C
• Canonical SMILES: CN1CCNCC1(C)C
• InChI: InChI=1S/C7H16N2/c1-7(2)6-8-4-5-9(7)3/h8H,4-6H2,1-3H3
• InChIKey: RFAPOGMFZTYBEW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,2,2-trimethylpiperazine
• IUPAC Traditional name: 1,2,2-trimethylpiperazine
• Synonyms: 1,2,2-trimethylpiperazine

Database IDs

• CAS Number: 396133-32-7
• MDL Number: MFCD09971266

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -3.3232193
• LogD (pH = 7.4): -2.0819802
• Log P: 0.3513928
• Molar Refractivity: 39.8005 cm^3
• Polarizability: 15.965017 Å^3
• Polar Surface Area: 15.27 Å^2