2-(4-ethoxyphenoxy)propanehydrazide

• ChemBase ID: 232633
• Molecular Formular: C11H16N2O3
• Molecular Mass: 224.25634
• Monoisotopic Mass: 224.11609238
• SMILES: C(=O)(C(Oc1ccc(cc1)OCC)C)NN
• Canonical SMILES: CCOc1ccc(cc1)OC(C(=O)NN)C
• InChI: InChI=1S/C11H16N2O3/c1-3-15-9-4-6-10(7-5-9)16-8(2)11(14)13-12/h4-8H,3,12H2,1-2H3,(H,13,14)
• InChIKey: OBKVJBHGVUOQIC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(4-ethoxyphenoxy)propanehydrazide
• IUPAC Traditional name: 2-(4-ethoxyphenoxy)propanehydrazide
• Synonyms: 2-(4-ethoxyphenoxy)propanohydrazide

Database IDs

• MDL Number: MFCD04618153
• PubChem SID: 164288543
• PubChem CID: 3565926

CALCULATED PROPERTIES

• Acid pKa: 11.8601885
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 0.9566425
• LogD (pH = 7.4): 0.9580092
• Log P: 0.9580405
• Molar Refractivity: 60.6178 cm^3
• Polarizability: 23.536524 Å^3
• Polar Surface Area: 73.58 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.136

Product Information

• Purity: 95%