[(3,5-difluorophenyl)methyl]hydrazine

• ChemBase ID: 117841
• Molecular Formular: C7H8F2N2
• Molecular Mass: 158.1486264
• Monoisotopic Mass: 158.06555471
• SMILES: c1c(cc(cc1F)CNN)F
• Canonical SMILES: NNCc1cc(F)cc(c1)F
• InChI: InChI=1S/C7H8F2N2/c8-6-1-5(4-11-10)2-7(9)3-6/h1-3,11H,4,10H2
• InChIKey: LHKTVYHGYDEKQB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(3,5-difluorophenyl)methyl]hydrazine
• IUPAC Traditional name: [(3,5-difluorophenyl)methyl]hydrazine
• Synonyms: (3,5-difluorobenzyl)hydrazine hydrochloride

Database IDs

• MDL Number: MFCD16660422
• PubChem SID: 162089643
• PubChem CID: 20112914

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.044633
• LogD (pH = 7.4): 1.1974211
• Log P: 1.1997627
• Molar Refractivity: 49.9411 cm^3
• Polarizability: 14.416775 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Partition Coefficient: 1.224

Product Information

• Purity: 95+%
• Salt Data: HCl