1-[(4-chlorophenyl)methyl]-1-[4-(propan-2-yl)phenyl]hydrazine hydrochloride

• ChemBase ID: 164136
• Molecular Formular: C16H20Cl2N2
• Molecular Mass: 311.2494
• Monoisotopic Mass: 310.10035401
• SMILES: c1(N(Cc2ccc(cc2)Cl)N)ccc(cc1)C(C)C.Cl
• Canonical SMILES: Clc1ccc(cc1)CN(c1ccc(cc1)C(C)C)N.Cl
• InChI: InChI=1S/C16H19ClN2.ClH/c1-12(2)14-5-9-16(10-6-14)19(18)11-13-3-7-15(17)8-4-13;/h3-10,12H,11,18H2,1-2H3;1H
• InChIKey: FVMVSRHYHAREGQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-[(4-chlorophenyl)methyl]-1-[4-(propan-2-yl)phenyl]hydrazine hydrochloride
• IUPAC Traditional name: 1-[(4-chlorophenyl)methyl]-1-(4-isopropylphenyl)hydrazine hydrochloride
• Synonyms: 1-[(4-Chlorophenyl)methyl]-1-[4-(1-methylethyl)phenyl]hydrazine Monohydrochloride; 1-(4-Chlorobenzyl)-1-[4-(isopropyl)phenyl]hydrazine, Hydrochloride

Database IDs

• CAS Number: 113243-68-8
• PubChem SID: 162258271
• PubChem CID: 19752394

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 4.4586473
• LogD (pH = 7.4): 4.972581
• Log P: 4.9853315
• Molar Refractivity: 93.1782 cm^3
• Polarizability: 31.645145 Å^3
• Polar Surface Area: 29.26 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Dichloromethane; Ethanol; Methanol
• Apperance: Pink Solid
• Melting Point: 181-182°C