(3,5-difluoro-2-methoxyphenyl)hydrazine

• ChemBase ID: 238292
• Molecular Formular: C7H8F2N2O
• Molecular Mass: 174.1480264
• Monoisotopic Mass: 174.06046933
• SMILES: c1(c(c(cc(c1)F)F)OC)NN
• Canonical SMILES: NNc1cc(F)cc(c1OC)F
• InChI: InChI=1S/C7H8F2N2O/c1-12-7-5(9)2-4(8)3-6(7)11-10/h2-3,11H,10H2,1H3
• InChIKey: GRVSZVZSPQFYOB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (3,5-difluoro-2-methoxyphenyl)hydrazine
• IUPAC Traditional name: (3,5-difluoro-2-methoxyphenyl)hydrazine
• Synonyms: (3,5-difluoro-2-methoxyphenyl)hydrazine

Database IDs

• MDL Number: MFCD11847496
• PubChem SID: 164294202
• PubChem CID: 53414309

CALCULATED PROPERTIES

• Acid pKa: 15.940899
• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 1.4481784
• LogD (pH = 7.4): 1.4919297
• Log P: 1.4926211
• Molar Refractivity: 42.6607 cm^3
• Polarizability: 14.910129 Å^3
• Polar Surface Area: 47.28 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.757

Product Information

• Purity: 95%