N-(2-hydroxyethyl)dodecanamide

• ChemBase ID: 107090
• Molecular Formular: C14H29NO2
• Molecular Mass: 243.38556
• Monoisotopic Mass: 243.21982917
• SMILES: CCCCCCCCCCCC(=O)NCCO
• Canonical SMILES: CCCCCCCCCCCC(=O)NCCO
• InChI: InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-10-11-14(17)15-12-13-16/h16H,2-13H2,1H3,(H,15,17)
• InChIKey: QZXSMBBFBXPQHI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-(2-hydroxyethyl)dodecanamide
• IUPAC Traditional name: lauroyl-EA
• Synonyms: LAURIC ISOPROPANOLAMIDE; N-(2-Hydroxyethyl)dodecanamide

Database IDs

• CAS Number: 142-78-9
• MDL Number: MFCD00020561
• PubChem SID: 162093157
• PubChem CID: 8899

CALCULATED PROPERTIES

• Acid pKa: 15.463162
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 3.2049396
• LogD (pH = 7.4): 3.2049396
• Log P: 3.2049396
• Molar Refractivity: 71.6908 cm^3
• Polarizability: 28.341347 Å^3
• Polar Surface Area: 49.33 Å^2
• Rotatable Bonds: 12
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 90%; 95+%

DETAILS

MP Biomedicals - 05202513

MP Biomedicals Rare Chemical collection