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159087-46-4 molecular structure
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trimethyl[2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane

ChemBase ID: 814669
Molecular Formular: C11H21BO2Si
Molecular Mass: 224.17974
Monoisotopic Mass: 224.14038684
SMILES and InChIs

SMILES:
[Si](C#CB1OC(C(O1)(C)C)(C)C)(C)(C)C
Canonical SMILES:
C[Si](C#CB1OC(C(O1)(C)C)(C)C)(C)C
InChI:
InChI=1S/C11H21BO2Si/c1-10(2)11(3,4)14-12(13-10)8-9-15(5,6)7/h1-7H3
InChIKey:
WIAMOTQUYWWPCK-UHFFFAOYSA-N

Cite this record

CBID:814669 http://www.chembase.cn/molecule-814669.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trimethyl[2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane
IUPAC Traditional name
trimethyl[2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl]silane
Synonyms
trimethyl((4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethynyl)silane
CAS Number
159087-46-4

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
A&J Pharmtech AJA-O36882 external link Add to cart
Data Source Data ID Price
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Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.3172  LogD (pH = 7.4) 4.3172 
Log P 4.3172  Molar Refractivity 52.2861 cm3
Polarizability 25.464407 Å3 Polar Surface Area 18.46 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Product Information Bioassay(PubChem)
Purity
98% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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