[(3-fluoro-4-methylphenyl)methyl]hydrazine hydrochloride

• ChemBase ID: 100703
• Molecular Formular: C8H12ClFN2
• Molecular Mass: 190.6456832
• Monoisotopic Mass: 190.06730429
• SMILES: N(Cc1cc(c(cc1)C)F)N.Cl
• Canonical SMILES: NNCc1ccc(c(c1)F)C.Cl
• InChI: InChI=1S/C8H11FN2.ClH/c1-6-2-3-7(5-11-10)4-8(6)9;/h2-4,11H,5,10H2,1H3;1H
• InChIKey: ZKDXYOYYSFFVCP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(3-fluoro-4-methylphenyl)methyl]hydrazine hydrochloride
• IUPAC Traditional name: [(3-fluoro-4-methylphenyl)methyl]hydrazine hydrochloride
• Synonyms: (4-Methyl-3-fluorobenzyl)hydrazine hydrochloride

Database IDs

• MDL Number: MFCD08458141
• PubChem SID: 162087755
• PubChem CID: 44717747

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.380942
• LogD (pH = 7.4): 1.5674996
• Log P: 1.5704821
• Molar Refractivity: 54.7659 cm^3
• Polarizability: 16.43577 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: Corrosive/Store Cold