hexacosan-10-ol

• ChemBase ID: 112502
• Molecular Formular: C26H54O
• Molecular Mass: 382.70636
• Monoisotopic Mass: 382.41746635
• SMILES: CCCCCCCCCCCCCCCCC(O)CCCCCCCCC
• Canonical SMILES: CCCCCCCCCCCCCCCCC(CCCCCCCCC)O
• InChI: InChI=1S/C26H54O/c1-3-5-7-9-11-12-13-14-15-16-17-19-21-23-25-26(27)24-22-20-18-10-8-6-4-2/h26-27H,3-25H2,1-2H3
• InChIKey: SQPREXYCBSQGDO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: hexacosan-10-ol
• IUPAC Traditional name: hexacosan-10-ol
• Synonyms: n-HEXACOSANOL-10

Database IDs

• PubChem SID: 162106691
• PubChem CID: 44135582

CALCULATED PROPERTIES

• Acid pKa: 18.484173
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 10.635793
• LogD (pH = 7.4): 10.635793
• Log P: 10.635793
• Molar Refractivity: 123.0977 cm^3
• Polarizability: 49.328854 Å^3
• Polar Surface Area: 20.23 Å^2
• Rotatable Bonds: 23
• Lipinski's Rule of Five: false

DETAILS

MP Biomedicals - 05224446

MP Biomedicals Rare Chemical collection