N-hydroxy-N-phenylhexadecanamide

• ChemBase ID: 184477
• Molecular Formular: C22H37NO2
• Molecular Mass: 347.53468
• Monoisotopic Mass: 347.28242943
• SMILES: N(C(=O)CCCCCCCCCCCCCCC)(c1ccccc1)O
• Canonical SMILES: CCCCCCCCCCCCCCCC(=O)N(c1ccccc1)O
• InChI: InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-22(24)23(25)21-18-15-14-16-19-21/h14-16,18-19,25H,2-13,17,20H2,1H3
• InChIKey: WGMPVZJEXPNBCF-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-hydroxy-N-phenylhexadecanamide
• IUPAC Traditional name: N-hydroxy-N-phenylhexadecanamide

Database IDs

• PubChem SID: 164240387
• PubChem CID: 3833468

CALCULATED PROPERTIES

• Acid pKa: 8.733253
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 7.3278403
• LogD (pH = 7.4): 7.30847
• Log P: 7.328093
• Molar Refractivity: 105.3447 cm^3
• Polarizability: 41.622818 Å^3
• Polar Surface Area: 40.54 Å^2
• Rotatable Bonds: 15
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Classification: Rare Derivatives of Natural Compounds