[(2,5-difluorophenyl)methyl]hydrazine hydrochloride

• ChemBase ID: 238129
• Molecular Formular: C7H9ClF2N2
• Molecular Mass: 194.6095664
• Monoisotopic Mass: 194.04223242
• SMILES: c1(c(ccc(c1)F)F)CNN.Cl
• Canonical SMILES: NNCc1cc(F)ccc1F.Cl
• InChI: InChI=1S/C7H8F2N2.ClH/c8-6-1-2-7(9)5(3-6)4-11-10;/h1-3,11H,4,10H2;1H
• InChIKey: BPDFENNAKCHDCM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2,5-difluorophenyl)methyl]hydrazine hydrochloride
• IUPAC Traditional name: [(2,5-difluorophenyl)methyl]hydrazine hydrochloride
• Synonyms: [(2,5-difluorophenyl)methyl]hydrazine hydrochloride

Database IDs

• MDL Number: MFCD22375346
• PubChem SID: 164294039
• PubChem CID: 71756099

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.0767827
• LogD (pH = 7.4): 1.1979764
• Log P: 1.1997627
• Molar Refractivity: 49.9411 cm^3
• Polarizability: 14.417033 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 131 - 133°C
• Hydrophobicity(logP): 0.99

Product Information

• Purity: 95%