2,3-dihydrazinylquinoxaline

• ChemBase ID: 239893
• Molecular Formular: C8H10N6
• Molecular Mass: 190.2052
• Monoisotopic Mass: 190.09669435
• SMILES: c1(c(nc2c(n1)cccc2)NN)NN
• Canonical SMILES: NNc1nc2ccccc2nc1NN
• InChI: InChI=1S/C8H10N6/c9-13-7-8(14-10)12-6-4-2-1-3-5(6)11-7/h1-4H,9-10H2,(H,11,13)(H,12,14)
• InChIKey: DKEMNWRTZHXCJR-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2,3-dihydrazinylquinoxaline
• IUPAC Traditional name: 2,3-dihydrazinylquinoxaline
• Synonyms: 2,3-dihydrazinylquinoxaline

Database IDs

• MDL Number: MFCD00181991
• PubChem SID: 164295803
• PubChem CID: 155947

CALCULATED PROPERTIES

• Acid pKa: 17.579395
• H Acceptors: 6
• H Donor: 4
• LogD (pH = 5.5): 1.264328
• LogD (pH = 7.4): 1.2711905
• Log P: 1.2712786
• Molar Refractivity: 57.4908 cm^3
• Polarizability: 21.173447 Å^3
• Polar Surface Area: 101.88 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.152

Product Information

• Purity: 95%