N-hydroxy-N-phenylbenzamide

• ChemBase ID: 108429
• Molecular Formular: C13H11NO2
• Molecular Mass: 213.23194
• Monoisotopic Mass: 213.0789786
• SMILES: ON(C(=O)c1ccccc1)c1ccccc1
• Canonical SMILES: ON(C(=O)c1ccccc1)c1ccccc1
• InChI: InChI=1S/C13H11NO2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,16H
• InChIKey: YLYIXDZITBMCIW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-hydroxy-N-phenylbenzamide
• IUPAC Traditional name: N-hydroxy-N-phenylbenzamide
• Synonyms: N-Phenylbenzohydroxamic acid; N-Hydroxy-N-phenylbenzamide; N-Benzoyl-N-phenylhydroxylamine; N-BENZOYLPHENYLHYDROXYLAMINE; N-Hydroxybenzanilide; N-羟基-N-苯基苯甲酰胺; N-苯甲酰苯基羟胺; N-苯甲酰基-N-苯基羟胺; N-苯甲酰基-N-苯羟基胺

Database IDs

• CAS Number: 304-88-1
• EC Number: 206-158-9
• MDL Number: MFCD00002111
• Beilstein Number: 2212449
• PubChem SID: 162094379; 24856609
• PubChem CID: 67536

CALCULATED PROPERTIES

• Acid pKa: 8.446729
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.7018502
• LogD (pH = 7.4): 2.6651564
• Log P: 2.702339
• Molar Refractivity: 61.5753 cm^3
• Polarizability: 23.544127 Å^3
• Polar Surface Area: 40.54 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 118-120 °C(lit.); 118-120°C; 121-123 °C

Safety Information

• German water hazard class: 3
• TSCA Listed: 是
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
• Storage Temperature: 2-8°C

Product Information

• Purity: ≥98.0% (N); 98%
• Grade: purum
• Linear Formula: C6H5CON(OH)C6H5

DETAILS

MP Biomedicals - 05207315

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 274852

Packaging
5 g in glass bottle