N-(4-phenylphenyl)hydroxylamine

• ChemBase ID: 170094
• Molecular Formular: C12H11NO
• Molecular Mass: 185.22184
• Monoisotopic Mass: 185.08406398
• SMILES: c1ccccc1c1ccc(cc1)NO
• Canonical SMILES: ONc1ccc(cc1)c1ccccc1
• InChI: InChI=1S/C12H11NO/c14-13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13-14H
• InChIKey: MYVLYOJYVMLSFA-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-(4-phenylphenyl)hydroxylamine
• IUPAC Traditional name: N-hydroxy-4-aminobiphenyl
• Synonyms: N-Biphenyl-4-yl-hydroxylamine; N-Hydroxy-4-aminobiphenyl

Database IDs

• CAS Number: 6810-26-0
• PubChem SID: 164226004
• PubChem CID: 81261

CALCULATED PROPERTIES

• Acid pKa: 14.826041
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 3.128741
• LogD (pH = 7.4): 3.128741
• Log P: 3.128741
• Molar Refractivity: 58.1814 cm^3
• Polarizability: 23.10817 Å^3
• Polar Surface Area: 32.26 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Acetone; Ether
• Apperance: Yellow Solid

Safety Information

• Storage Warning: Moisture and Temperature Sensitive