2-(2-hydroxyphenyl)acetamide

• ChemBase ID: 240401
• Molecular Formular: C8H9NO2
• Molecular Mass: 151.16256
• Monoisotopic Mass: 151.06332853
• SMILES: C(=O)(Cc1c(O)cccc1)N
• Canonical SMILES: NC(=O)Cc1ccccc1O
• InChI: InChI=1S/C8H9NO2/c9-8(11)5-6-3-1-2-4-7(6)10/h1-4,10H,5H2,(H2,9,11)
• InChIKey: NPEGHCREQHYERS-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-(2-hydroxyphenyl)acetamide
• IUPAC Traditional name: 2-(2-hydroxyphenyl)acetamide
• Synonyms: 2-(2-hydroxyphenyl)acetamide

Database IDs

• MDL Number: MFCD00025519
• PubChem SID: 164296311
• PubChem CID: 89720

CALCULATED PROPERTIES

• Acid pKa: 9.286267
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 0.50041556
• LogD (pH = 7.4): 0.4949133
• Log P: 0.5004862
• Molar Refractivity: 41.1687 cm^3
• Polarizability: 15.825999 Å^3
• Polar Surface Area: 63.32 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -0.263

Product Information

• Purity: 95%