1-benzyl-1-phenylhydrazine hydrochloride

• ChemBase ID: 87177
• Molecular Formular: C13H15ClN2
• Molecular Mass: 234.7246
• Monoisotopic Mass: 234.09237617
• SMILES: N(c1ccccc1)(Cc1ccccc1)N.Cl
• Canonical SMILES: NN(c1ccccc1)Cc1ccccc1.Cl
• InChI: InChI=1S/C13H14N2.ClH/c14-15(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12;/h1-10H,11,14H2;1H
• InChIKey: JTYLHYOCBGPMNO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-benzyl-1-phenylhydrazine hydrochloride
• IUPAC Traditional name: 1-benzyl-1-phenylhydrazine hydrochloride
• Synonyms: 1-Benzyl-1-phenylhydrazine hydrochloride 99 %; N-Benzyl-N-phenylhydrazine hydrochloride; 1-benzyl-1-phenylhydrazine hydrochloride; N-苄基-N-苯肼盐酸盐

Database IDs

• CAS Number: 5705-15-7
• EC Number: 227-195-7
• MDL Number: MFCD00050690
• Beilstein Number: 3707186
• PubChem SID: 162074293
• PubChem CID: 79785

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.6185632
• LogD (pH = 7.4): 3.123894
• Log P: 3.1362777
• Molar Refractivity: 74.1826 cm^3
• Polarizability: 24.38848 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 178 - 180°C; 178-181°C
• Hydrophobicity(logP): 0.0

Safety Information

• RTECS: MU9800000
• European Hazard Symbols: Irritant (Xi)
• Risk Statements: 36/37/38
• Safety Statements: 26-37
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305+P351+P338-P302+P352-P321-P405-P501A

Product Information

• Purity: 95%; 98+%