2-(4-hydrazinyl-6-methylpyrimidin-2-yl)phenol

• ChemBase ID: 310661
• Molecular Formular: C11H12N4O
• Molecular Mass: 216.23918
• Monoisotopic Mass: 216.10111102
• SMILES: c1(nc(cc(n1)C)NN)c1c(O)cccc1
• Canonical SMILES: NNc1cc(C)nc(n1)c1ccccc1O
• InChI: InChI=1S/C11H12N4O/c1-7-6-10(15-12)14-11(13-7)8-4-2-3-5-9(8)16/h2-6,16H,12H2,1H3,(H,13,14,15)
• InChIKey: GQTRGNQVUCOOHT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(4-hydrazinyl-6-methylpyrimidin-2-yl)phenol
• IUPAC Traditional name: 2-(4-hydrazinyl-6-methylpyrimidin-2-yl)phenol
• Synonyms: 2-(4-hydrazino-6-methylpyrimidin-2-yl)phenol

Database IDs

• CAS Number: 300358-31-0
• MDL Number: MFCD00476689

CALCULATED PROPERTIES

• H Acceptors: 5
• H Donor: 3
• LogD (pH = 5.5): 2.1057415
• LogD (pH = 7.4): 1.9271767
• Log P: 2.2844346
• Molar Refractivity: 74.726 cm^3
• Polarizability: 23.742373 Å^3
• Polar Surface Area: 84.06 Å^2