2-hydroxy-N-phenylacetamide

• ChemBase ID: 273606
• Molecular Formular: C8H9NO2
• Molecular Mass: 151.16256
• Monoisotopic Mass: 151.06332853
• SMILES: C(=O)(Nc1ccccc1)CO
• Canonical SMILES: OCC(=O)Nc1ccccc1
• InChI: InChI=1S/C8H9NO2/c10-6-8(11)9-7-4-2-1-3-5-7/h1-5,10H,6H2,(H,9,11)
• InChIKey: PJFNNMFXEVADGK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-hydroxy-N-phenylacetamide
• IUPAC Traditional name: hydroxyacetanilide
• Synonyms: 2-hydroxy-N-phenylacetamide

Database IDs

• MDL Number: MFCD00068778
• PubChem SID: 164329516
• PubChem CID: 264260

CALCULATED PROPERTIES

• Acid pKa: 12.898906
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.3937081
• LogD (pH = 7.4): 0.39370683
• Log P: 0.39370814
• Molar Refractivity: 42.6232 cm^3
• Polarizability: 15.831913 Å^3
• Polar Surface Area: 49.33 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 79 - 81°C
• Hydrophobicity(logP): 0.497

Product Information

• Purity: 95%