1-benzyl-2-[(3-methoxyphenyl)methyl]hydrazine hydrochloride

• ChemBase ID: 101823
• Molecular Formular: C15H19ClN2O
• Molecular Mass: 278.77716
• Monoisotopic Mass: 278.11859092
• SMILES: N(NCc1ccccc1)Cc1cc(OC)ccc1.Cl
• Canonical SMILES: COc1cccc(c1)CNNCc1ccccc1.Cl
• InChI: InChI=1S/C15H18N2O.ClH/c1-18-15-9-5-8-14(10-15)12-17-16-11-13-6-3-2-4-7-13;/h2-10,16-17H,11-12H2,1H3;1H
• InChIKey: YPATWESTBAERSO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-benzyl-2-[(3-methoxyphenyl)methyl]hydrazine hydrochloride
• IUPAC Traditional name: 1-benzyl-2-[(3-methoxyphenyl)methyl]hydrazine hydrochloride
• Synonyms: 1-benzyl-2-(3-methoxybenzyl)hydrazine hydrochloride

Database IDs

• PubChem SID: 162105640
• PubChem CID: 71300133

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 2
• LogD (pH = 5.5): 2.3346462
• LogD (pH = 7.4): 2.6975362
• Log P: 2.7048368
• Molar Refractivity: 94.9116 cm^3
• Polarizability: 29.009228 Å^3
• Polar Surface Area: 33.29 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95%