4-hydrazinyl-7-methylquinoline

• ChemBase ID: 239632
• Molecular Formular: C10H11N3
• Molecular Mass: 173.21444
• Monoisotopic Mass: 173.09529737
• SMILES: c12c(nccc2NN)cc(cc1)C
• Canonical SMILES: NNc1ccnc2c1ccc(c2)C
• InChI: InChI=1S/C10H11N3/c1-7-2-3-8-9(13-11)4-5-12-10(8)6-7/h2-6H,11H2,1H3,(H,12,13)
• InChIKey: UCXZZGTXWNNKQI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 4-hydrazinyl-7-methylquinoline
• IUPAC Traditional name: 4-hydrazinyl-7-methylquinoline
• Synonyms: 4-hydrazinyl-7-methylquinoline

Database IDs

• MDL Number: MFCD00272469
• PubChem SID: 164295542
• PubChem CID: 12443533

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 1.0764225
• LogD (pH = 7.4): 1.9718469
• Log P: 2.0359645
• Molar Refractivity: 54.7272 cm^3
• Polarizability: 21.323278 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.623

Product Information

• Purity: 95%