2-(2,2-diethylhydrazin-1-yl)ethan-1-ol

• ChemBase ID: 108174
• Molecular Formular: C6H16N2O
• Molecular Mass: 132.20404
• Monoisotopic Mass: 132.12626314
• SMILES: CCN(CC)NCCO
• Canonical SMILES: OCCNN(CC)CC
• InChI: InChI=1S/C6H16N2O/c1-3-8(4-2)7-5-6-9/h7,9H,3-6H2,1-2H3
• InChIKey: XPKBZAZTMIVEIF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2,2-diethylhydrazin-1-yl)ethan-1-ol
• IUPAC Traditional name: 2-(2,2-diethylhydrazin-1-yl)ethanol
• Synonyms: DIETHYLAMINOETHANOLAMINE

Database IDs

• PubChem SID: 162106115
• PubChem CID: 25021532

CALCULATED PROPERTIES

• Acid pKa: 15.554132
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): -1.2831414
• LogD (pH = 7.4): -0.6401034
• Log P: -0.62083024
• Molar Refractivity: 49.2945 cm^3
• Polarizability: 15.252584 Å^3
• Polar Surface Area: 35.5 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05206339

MP Biomedicals Rare Chemical collection