(4-chlorophenyl)hydrazine hydrate hydrochloride

• ChemBase ID: 293279
• Molecular Formular: C6H10Cl2N2O
• Molecular Mass: 197.0624
• Monoisotopic Mass: 196.01701831
• SMILES: NNc1ccc(Cl)cc1.Cl.O
• Canonical SMILES: NNc1ccc(cc1)Cl.O.Cl
• InChI: InChI=1S/C6H7ClN2.ClH.H2O/c7-5-1-3-6(9-8)4-2-5;;/h1-4,9H,8H2;1H;1H2
• InChIKey: PZOOJSWCXWTGFM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-chlorophenyl)hydrazine hydrate hydrochloride
• IUPAC Traditional name: 4-chlorophenylhydrazine hydrate hydrochloride
• Synonyms: (4-Chlorophenyl)hydrazine hydrochloride hydrate

Database IDs

• PubChem SID: 180678810
• PubChem CID: 71607345

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.7683083
• LogD (pH = 7.4): 1.9657333
• Log P: 1.9689331
• Molar Refractivity: 40.5695 cm^3
• Polarizability: 14.744404 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%