2-hydroxy-2,2-diphenylacetamide

• ChemBase ID: 109874
• Molecular Formular: C14H13NO2
• Molecular Mass: 227.25852
• Monoisotopic Mass: 227.09462866
• SMILES: NC(=O)C(O)(c1ccccc1)c1ccccc1
• Canonical SMILES: NC(=O)C(c1ccccc1)(c1ccccc1)O
• InChI: InChI=1S/C14H13NO2/c15-13(16)14(17,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,17H,(H2,15,16)
• InChIKey: REQXYFLFNBBIRX-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-hydroxy-2,2-diphenylacetamide
• IUPAC Traditional name: 2-hydroxy-2,2-diphenylacetamide
• Synonyms: Diphenylglycolamide; Benzilamide; BENZILIC ACID AMIDE; Benzilamide; 2-羟基-2,2-二苯基乙酰胺

Database IDs

• CAS Number: 4746-87-6
• MDL Number: MFCD00008010
• PubChem SID: 162095366
• PubChem CID: 78483

CALCULATED PROPERTIES

• Acid pKa: 11.506753
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.750604
• LogD (pH = 7.4): 1.7505705
• Log P: 1.7506045
• Molar Refractivity: 65.3043 cm^3
• Polarizability: 25.420427 Å^3
• Polar Surface Area: 63.32 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%
• Empirical Formula (Hill Notation): C14H13NO2

DETAILS

MP Biomedicals - 05212848

MP Biomedicals Rare Chemical collection