nonanamide

• ChemBase ID: 271998
• Molecular Formular: C9H19NO
• Molecular Mass: 157.25326
• Monoisotopic Mass: 157.14666423
• SMILES: C(=O)(N)CCCCCCCC
• Canonical SMILES: CCCCCCCCC(=O)N
• InChI: InChI=1S/C9H19NO/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H2,10,11)
• InChIKey: GHLZUHZBBNDWHW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: nonanamide
• IUPAC Traditional name: nonanamide
• Synonyms: nonanamide

Database IDs

• MDL Number: MFCD00025540
• PubChem SID: 164327908
• PubChem CID: 70709

CALCULATED PROPERTIES

• Acid pKa: 17.171732
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 2.3376591
• LogD (pH = 7.4): 2.3376596
• Log P: 2.3376596
• Molar Refractivity: 46.6988 cm^3
• Polarizability: 18.514233 Å^3
• Polar Surface Area: 43.09 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 96 - 98°C
• Hydrophobicity(logP): 2.589

Product Information

• Purity: 95%