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2,4,6-trimethyl-2,4,6-triphenyl-1,3,5,2,4,6-trioxatrisilinane
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ChemBase ID:
152297
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Molecular Formular:
C21H24O3Si3
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Molecular Mass:
408.66996
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Monoisotopic Mass:
408.10332422
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SMILES and InChIs
SMILES:
C[Si]1(O[Si](O[Si](O1)(C)c1ccccc1)(C)c1ccccc1)c1ccccc1
Canonical SMILES:
C[Si]1(O[Si](C)(O[Si](O1)(C)c1ccccc1)c1ccccc1)c1ccccc1
InChI:
InChI=1S/C21H24O3Si3/c1-25(19-13-7-4-8-14-19)22-26(2,20-15-9-5-10-16-20)24-27(3,23-25)21-17-11-6-12-18-21/h4-18H,1-3H3
InChIKey:
HAURRGANAANPSQ-UHFFFAOYSA-N
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Cite this record
CBID:152297 http://www.chembase.cn/molecule-152297.html
NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2,4,6-trimethyl-2,4,6-triphenyl-1,3,5,2,4,6-trioxatrisilinane
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IUPAC Traditional name
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2,4,6-trimethyl-2,4,6-triphenyl-1,3,5,2,4,6-trioxatrisilinane
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Synonyms
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2,4,6-Trimethyl-2,4,6-triphenylcyclotrisiloxane
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2,4,6-三甲基-2,4,6-三苯基环三硅氧烷
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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
H Acceptors
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3
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H Donor
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0
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LogD (pH = 5.5)
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4.9353
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LogD (pH = 7.4)
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4.9353
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Log P
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4.9353
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Molar Refractivity
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98.3106 cm3
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Polarizability
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45.170765 Å3
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Polar Surface Area
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27.69 Å2
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Rotatable Bonds
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3
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Lipinski's Rule of Five
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true
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DETAILS
DETAILS
Sigma Aldrich
PATENTS
PATENTS
PubChem Patent
Google Patent