2-(2-hydroxyphenoxy)acetohydrazide

• ChemBase ID: 271994
• Molecular Formular: C8H10N2O3
• Molecular Mass: 182.1766
• Monoisotopic Mass: 182.06914219
• SMILES: C(=O)(NN)COc1c(O)cccc1
• Canonical SMILES: NNC(=O)COc1ccccc1O
• InChI: InChI=1S/C8H10N2O3/c9-10-8(12)5-13-7-4-2-1-3-6(7)11/h1-4,11H,5,9H2,(H,10,12)
• InChIKey: HOWDHDBKKZVMKY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-hydroxyphenoxy)acetohydrazide
• IUPAC Traditional name: 2-(2-hydroxyphenoxy)acetohydrazide
• Synonyms: 2-(2-hydroxyphenoxy)acetohydrazide

Database IDs

• MDL Number: MFCD00981927
• PubChem SID: 164327904
• PubChem CID: 1547697

CALCULATED PROPERTIES

• Acid pKa: 9.920307
• H Acceptors: 4
• H Donor: 3
• LogD (pH = 5.5): -0.11486044
• LogD (pH = 7.4): -0.11474241
• Log P: -0.11342577
• Molar Refractivity: 46.893 cm^3
• Polarizability: 17.972021 Å^3
• Polar Surface Area: 84.58 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 152 - 154°C
• Hydrophobicity(logP): -0.528

Product Information

• Purity: 95%