2-(2-ethoxyphenoxy)acetohydrazide

• ChemBase ID: 230534
• Molecular Formular: C10H14N2O3
• Molecular Mass: 210.22976
• Monoisotopic Mass: 210.10044232
• SMILES: C(=O)(NN)COc1c(OCC)cccc1
• Canonical SMILES: CCOc1ccccc1OCC(=O)NN
• InChI: InChI=1S/C10H14N2O3/c1-2-14-8-5-3-4-6-9(8)15-7-10(13)12-11/h3-6H,2,7,11H2,1H3,(H,12,13)
• InChIKey: MWRUXMIKCBHQHV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-ethoxyphenoxy)acetohydrazide
• IUPAC Traditional name: 2-(2-ethoxyphenoxy)acetohydrazide
• Synonyms: (2-Ethoxy-phenoxy)-acetic acid hydrazide

Database IDs

• MDL Number: MFCD00705187
• PubChem SID: 164286444
• PubChem CID: 676790

CALCULATED PROPERTIES

• Acid pKa: 12.055047
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): 0.38785803
• LogD (pH = 7.4): 0.38924962
• Log P: 0.38927624
• Molar Refractivity: 56.1239 cm^3
• Polarizability: 21.704151 Å^3
• Polar Surface Area: 73.58 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 94 - 96°C
• Hydrophobicity(logP): 0.477

Product Information

• Purity: 95%