{1-[4-(propan-2-yl)phenyl]ethyl}hydrazine hydrochloride

• ChemBase ID: 260819
• Molecular Formular: C11H19ClN2
• Molecular Mass: 214.73496
• Monoisotopic Mass: 214.1236763
• SMILES: c1(ccc(cc1)C(C)C)C(NN)C.Cl
• Canonical SMILES: NNC(c1ccc(cc1)C(C)C)C.Cl
• InChI: InChI=1S/C11H18N2.ClH/c1-8(2)10-4-6-11(7-5-10)9(3)13-12;/h4-9,13H,12H2,1-3H3;1H
• InChIKey: YUBROWRUJJXPPP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {1-[4-(propan-2-yl)phenyl]ethyl}hydrazine hydrochloride
• IUPAC Traditional name: [1-(4-isopropylphenyl)ethyl]hydrazine hydrochloride
• Synonyms: 1-{1-[4-(propan-2-yl)phenyl]ethyl}hydrazine hydrochloride

Database IDs

• MDL Number: MFCD17167102
• PubChem SID: 164316729
• PubChem CID: 50988077

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 2.3188305
• LogD (pH = 7.4): 2.571547
• Log P: 2.575943
• Molar Refractivity: 68.1179 cm^3
• Polarizability: 22.355993 Å^3
• Polar Surface Area: 38.05 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 2.44

Product Information

• Purity: 95%