NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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3,6,9,12,15-pentaoxaheptadecane-1,17-diol
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IUPAC Traditional name
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Synonyms
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3,6,9,12,15-Pentaoxaheptadecane-1,17-diol
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Hexaethylene glycol
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六聚乙二醇
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六甘醇
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六聚乙二醇
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CAS Number
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EC Number
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MDL Number
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Beilstein 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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14.820126
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H Acceptors
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7
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H Donor
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2
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LogD (pH = 5.5)
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-1.4435567
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LogD (pH = 7.4)
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-1.4435567
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Log P
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-1.4435567
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Molar Refractivity
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69.7711 cm3
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Polarizability
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27.67533 Å3
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Polar Surface Area
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86.61 Å2
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Rotatable Bonds
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16
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
Sigma Aldrich
Sigma Aldrich -
259268
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Application Substrate employed in the synthesis of binaphthol-based macrocyclic ethers using intramolecular oxidative coupling with CuCl(OH)-TMEDA.1 Packaging 5, 25 g in poly bottle |
Sigma Aldrich -
52041
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Other Notes Important starting material for preparing macrocyclic polyethers1; building block in the synthesis of surfactants2 |
PATENTS
PATENTS
PubChem Patent
Google Patent