6-chloro-4-hydrazinyl-8-methylquinoline hydrochloride

• ChemBase ID: 805275
• Molecular Formular: C10H11Cl2N3
• Molecular Mass: 244.12044
• Monoisotopic Mass: 243.03300273
• SMILES: Cl.c1c(c2c(cc1Cl)c(ccn2)NN)C
• Canonical SMILES: NNc1ccnc2c1cc(Cl)cc2C.Cl
• InChI: InChI=1S/C10H10ClN3.ClH/c1-6-4-7(11)5-8-9(14-12)2-3-13-10(6)8;/h2-5H,12H2,1H3,(H,13,14);1H
• InChIKey: LGBBFAMZUMNJES-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 6-chloro-4-hydrazinyl-8-methylquinoline hydrochloride
• IUPAC Traditional name: 6-chloro-4-hydrazinyl-8-methylquinoline hydrochloride
• Synonyms: 6-CHLORO-4-HYDRAZINO-8-METHYLQUINOLINE HYDROCHLORIDE

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 2.1875584
• LogD (pH = 7.4): 2.6324592
• Log P: 2.6400092
• Molar Refractivity: 59.532 cm^3
• Polarizability: 23.128016 Å^3
• Polar Surface Area: 50.94 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%