[(2,5-difluorophenyl)methyl]hydrazine

• ChemBase ID: 259578
• Molecular Formular: C7H8F2N2
• Molecular Mass: 158.1486264
• Monoisotopic Mass: 158.06555471
• SMILES: c1(c(ccc(c1)F)F)CNN
• Canonical SMILES: NNCc1cc(F)ccc1F
• InChI: InChI=1S/C7H8F2N2/c8-6-1-2-7(9)5(3-6)4-11-10/h1-3,11H,4,10H2
• InChIKey: AGXLDIALWJZHMI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2,5-difluorophenyl)methyl]hydrazine
• IUPAC Traditional name: [(2,5-difluorophenyl)methyl]hydrazine
• Synonyms: 1-[(2,5-difluorophenyl)methyl]hydrazine

Database IDs

• CAS Number: 887595-45-1
• MDL Number: MFCD07786444
• PubChem SID: 164315488
• PubChem CID: 24701219

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

• Hydrophobicity(logP): 0.99

Product Information

• Purity: 95%