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2,5,8,11,14,17,20,23,26,29,32-undecaoxatetratriacontan-34-ol
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ChemBase ID:
139798
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Molecular Formular:
C23H48O12
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Molecular Mass:
516.62002
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Monoisotopic Mass:
516.31457698
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SMILES and InChIs
SMILES:
COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
Canonical SMILES:
COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
InChI:
InChI=1S/C23H48O12/c1-25-4-5-27-8-9-29-12-13-31-16-17-33-20-21-35-23-22-34-19-18-32-15-14-30-11-10-28-7-6-26-3-2-24/h24H,2-23H2,1H3
InChIKey:
VWDQSWKLHABGKL-UHFFFAOYSA-N
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Cite this record
CBID:139798 http://www.chembase.cn/molecule-139798.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2,5,8,11,14,17,20,23,26,29,32-undecaoxatetratriacontan-34-ol
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IUPAC Traditional name
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2,5,8,11,14,17,20,23,26,29,32-undecaoxatetratriacontan-34-ol
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Synonyms
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Methoxyundecaethylene glycol
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Monomethoxy-PEG (n=11)
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O-Methyl-undecaethylene glycol
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十一甘醇单甲醚
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单甲氧基-PEG(聚合度为 11)
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O-甲基-十一乙二醇
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CAS Number
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MDL Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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15.121156
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H Acceptors
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12
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H Donor
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1
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LogD (pH = 5.5)
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-1.0353076
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LogD (pH = 7.4)
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-1.0353076
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Log P
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-1.0353076
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Molar Refractivity
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129.7398 cm3
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Polarizability
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51.531277 Å3
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Polar Surface Area
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121.76 Å2
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Rotatable Bonds
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32
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Lipinski's Rule of Five
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false
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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent