2-(3-fluorophenyl)hydrazinium chloride

• ChemBase ID: 302049
• Molecular Formular: C6H8ClFN2
• Molecular Mass: 162.5925232
• Monoisotopic Mass: 162.03600417
• SMILES: c1cc(cc(c1)F)N[NH3+].[Cl-]
• Canonical SMILES: [NH3+]Nc1cccc(c1)F.[Cl-]
• InChI: InChI=1S/C6H7FN2.ClH/c7-5-2-1-3-6(4-5)9-8;/h1-4,9H,8H2;1H
• InChIKey: SKVGLOFWEJFQKU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(3-fluorophenyl)hydrazinium chloride
• IUPAC Traditional name: 2-(3-fluorophenyl)hydrazinium chloride
• Synonyms: 3-Fluorophenylhydrazine hydrochloride; 3-氟苯肼盐酸盐

Database IDs

• CAS Number: 2924-16-5
• EC Number: 220-886-4
• MDL Number: MFCD00012934
• Beilstein Number: 3627729

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 2
• LogD (pH = 5.5): 1.3411473
• LogD (pH = 7.4): 1.5050435
• Log P: 1.5075904
• Molar Refractivity: 46.2119 cm^3
• Polarizability: 12.599698 Å^3
• Polar Surface Area: 39.67 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: ca 268°C dec.

Safety Information

• European Hazard Symbols: X
• Risk Statements: 22-36/37/38
• Safety Statements: 26-36/37
• TSCA Listed: 否
• GHS Pictograms: GHS06
• GHS Hazard statements: H301-H315-H319-H335
• GHS Precautionary statements: P261-P301+P310-P305+P351+P338-P302+P352-P405-P501A

Product Information

• Purity: 98%