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trimethyl({[(2S,3S,4R,5R)-2,3,4-tris[(trimethylsilyl)oxy]-5-{[(trimethylsilyl)oxy]methyl}oxolan-2-yl]methoxy})silane
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ChemBase ID:
153539
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Molecular Formular:
C21H52O6Si5
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Molecular Mass:
541.06148
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Monoisotopic Mass:
540.26102204
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SMILES and InChIs
SMILES:
C[Si](C)(C)OC[C@@H]1[C@H]([C@@H]([C@](O1)(CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
Canonical SMILES:
C[Si](O[C@@H]1[C@@H](CO[Si](C)(C)C)O[C@@]([C@H]1O[Si](C)(C)C)(CO[Si](C)(C)C)O[Si](C)(C)C)(C)C
InChI:
InChI=1S/C21H52O6Si5/c1-28(2,3)22-16-18-19(25-30(7,8)9)20(26-31(10,11)12)21(24-18,27-32(13,14)15)17-23-29(4,5)6/h18-20H,16-17H2,1-15H3/t18-,19-,20+,21+/m1/s1
InChIKey:
PLNWQGWZBNJIQM-CGXNFDGLSA-N
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Cite this record
CBID:153539 http://www.chembase.cn/molecule-153539.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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trimethyl({[(2S,3S,4R,5R)-2,3,4-tris[(trimethylsilyl)oxy]-5-{[(trimethylsilyl)oxy]methyl}oxolan-2-yl]methoxy})silane
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IUPAC Traditional name
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trimethyl({[(2S,3S,4R,5R)-2,3,4-tris[(trimethylsilyl)oxy]-5-{[(trimethylsilyl)oxy]methyl}oxolan-2-yl]methoxy})silane
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Synonyms
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Trimethylsilyl-D-(-)-fructose
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三甲基硅基-D-(-)-果糖
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CAS 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
H Acceptors
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6
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H Donor
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0
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LogD (pH = 5.5)
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7.9237
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LogD (pH = 7.4)
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7.9237
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Log P
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7.9237
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Molar Refractivity
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116.9903 cm3
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Polarizability
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57.548737 Å3
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Polar Surface Area
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55.38 Å2
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Rotatable Bonds
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12
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Lipinski's Rule of Five
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false
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PATENTS
PATENTS
PubChem Patent
Google Patent