4-hydrazinyl-2,6-dimethylpyrimidine

• ChemBase ID: 22192
• Molecular Formular: C6H10N4
• Molecular Mass: 138.1704
• Monoisotopic Mass: 138.09054634
• SMILES: c1c(nc(nc1NN)C)C
• Canonical SMILES: NNc1cc(C)nc(n1)C
• InChI: InChI=1S/C6H10N4/c1-4-3-6(10-7)9-5(2)8-4/h3H,7H2,1-2H3,(H,8,9,10)
• InChIKey: HVAYIAWJHRUOBC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-hydrazinyl-2,6-dimethylpyrimidine
• IUPAC Traditional name: 4-hydrazinyl-2,6-dimethylpyrimidine
• Synonyms: (2,6-Dimethylpyrimidin-4-yl)hydrazine; 4-hydrazino-2,6-dimethylpyrimidine; 2,6-Dimethyl-4-hydrazinopyrimidine

Database IDs

• CAS Number: 14331-56-7
• MDL Number: MFCD00102150
• PubChem SID: 160985499
• PubChem CID: 736395

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -0.47104484
• LogD (pH = 7.4): 0.64356625
• Log P: 0.72054553
• Molar Refractivity: 41.9584 cm^3
• Polarizability: 14.63151 Å^3
• Polar Surface Area: 63.83 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 175°C
• Hydrophobicity(logP): 0.871

Safety Information

• Storage Warning: Harmful/Irritant; IRRITANT
• TSCA Listed: false

Product Information

• Purity: 95%