2-(3-methoxyphenyl)hydrazinium chloride

• ChemBase ID: 302069
• Molecular Formular: C7H11ClN2O
• Molecular Mass: 174.62804
• Monoisotopic Mass: 174.05599066
• SMILES: COc1cccc(c1)N[NH3+].[Cl-]
• Canonical SMILES: [NH3+]Nc1cccc(c1)OC.[Cl-]
• InChI: InChI=1S/C7H10N2O.ClH/c1-10-7-4-2-3-6(5-7)9-8;/h2-5,9H,8H2,1H3;1H
• InChIKey: GMXFZBZOVZOYNQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(3-methoxyphenyl)hydrazinium chloride
• IUPAC Traditional name: 2-(3-methoxyphenyl)hydrazinium chloride
• Synonyms: 3-Methoxyphenylhydrazine hydrochloride; 3-甲氧基苯肼 盐酸盐

Database IDs

• CAS Number: 39232-91-2
• EC Number: 254-368-4
• MDL Number: MFCD00044416
• Beilstein Number: 5304389

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.0079982
• LogD (pH = 7.4): 1.2040452
• Log P: 1.2072172
• Molar Refractivity: 52.4587 cm^3
• Polarizability: 15.43851 Å^3
• Polar Surface Area: 48.9 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: ca 142°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%