(3,5-difluorophenyl)hydrazine

• ChemBase ID: 94243
• Molecular Formular: C6H6F2N2
• Molecular Mass: 144.1220464
• Monoisotopic Mass: 144.04990464
• SMILES: N(c1cc(cc(c1)F)F)N
• Canonical SMILES: NNc1cc(F)cc(c1)F
• InChI: InChI=1S/C6H6F2N2/c7-4-1-5(8)3-6(2-4)10-9/h1-3,10H,9H2
• InChIKey: WSTOVLQLTOEWSI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3,5-difluorophenyl)hydrazine
• IUPAC Traditional name: (3,5-difluorophenyl)hydrazine
• Synonyms: (3,5-difluorophenyl)hydrazine; 3,5-Difluorophenylhydrazine

Database IDs

• MDL Number: MFCD06658248
• PubChem SID: 162080898
• PubChem CID: 2774213

CALCULATED PROPERTIES

• Acid pKa: 18.59681
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.5305713
• LogD (pH = 7.4): 1.6485444
• Log P: 1.6502923
• Molar Refractivity: 36.1975 cm^3
• Polarizability: 12.345015 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.959

Product Information

• Purity: 95%