(4-bromo-2-methylphenyl)hydrazine hydrochloride

• ChemBase ID: 269809
• Molecular Formular: C7H10BrClN2
• Molecular Mass: 237.5247
• Monoisotopic Mass: 235.97158801
• SMILES: c1(c(ccc(c1)Br)NN)C.Cl
• Canonical SMILES: NNc1ccc(cc1C)Br.Cl
• InChI: InChI=1S/C7H9BrN2.ClH/c1-5-4-6(8)2-3-7(5)10-9;/h2-4,10H,9H2,1H3;1H
• InChIKey: DXQUZPNVVNHBRF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-bromo-2-methylphenyl)hydrazine hydrochloride
• IUPAC Traditional name: (4-bromo-2-methylphenyl)hydrazine hydrochloride
• Synonyms: (4-bromo-2-methylphenyl)hydrazine hydrochloride

Database IDs

• MDL Number: MFCD04966813
• PubChem SID: 164325719
• PubChem CID: 16495412

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 2.4309406
• LogD (pH = 7.4): 2.6435494
• Log P: 2.6470625
• Molar Refractivity: 48.4287 cm^3
• Polarizability: 17.43599 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.929

Product Information

• Purity: 95%