[1-(4-chlorophenyl)ethyl]hydrazine dihydrochloride

• ChemBase ID: 267727
• Molecular Formular: C8H13Cl3N2
• Molecular Mass: 243.56122
• Monoisotopic Mass: 242.01443147
• SMILES: c1(ccc(cc1)Cl)C(NN)C.Cl.Cl
• Canonical SMILES: NNC(c1ccc(cc1)Cl)C.Cl.Cl
• InChI: InChI=1S/C8H11ClN2.2ClH/c1-6(11-10)7-2-4-8(9)5-3-7;;/h2-6,11H,10H2,1H3;2*1H
• InChIKey: FLCZVBRTXAISBU-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [1-(4-chlorophenyl)ethyl]hydrazine dihydrochloride
• IUPAC Traditional name: [1-(4-chlorophenyl)ethyl]hydrazine dihydrochloride
• Synonyms: [1-(4-chlorophenyl)ethyl]hydrazine dihydrochloride

Database IDs

• MDL Number: MFCD16547631
• PubChem SID: 164323637
• PubChem CID: 47003099

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.7054077
• LogD (pH = 7.4): 1.9311849
• Log P: 1.9349785
• Molar Refractivity: 58.7319 cm^3
• Polarizability: 18.718819 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.726

Product Information

• Purity: 95%