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33581-77-0 molecular structure
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trimethylsilyl 2-[(trimethylsilyl)oxy]acetate

ChemBase ID: 146763
Molecular Formular: C8H20O3Si2
Molecular Mass: 220.4136
Monoisotopic Mass: 220.09509756
SMILES and InChIs

SMILES:
C[Si](C)(C)OCC(=O)O[Si](C)(C)C
Canonical SMILES:
O=C(O[Si](C)(C)C)CO[Si](C)(C)C
InChI:
InChI=1S/C8H20O3Si2/c1-12(2,3)10-7-8(9)11-13(4,5)6/h7H2,1-6H3
InChIKey:
MAEQOWMWOCEXKP-UHFFFAOYSA-N

Cite this record

CBID:146763 http://www.chembase.cn/molecule-146763.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trimethylsilyl 2-[(trimethylsilyl)oxy]acetate
IUPAC Traditional name
trimethylsilyl 2-[(trimethylsilyl)oxy]acetate
Synonyms
Trimethylsilyl trimethylsiloxyacetate
三甲基硅基三甲硅氧基醋酸酯
CAS Number
33581-77-0
EC Number
251-580-9
MDL Number
MFCD00009840
Beilstein Number
2045011
PubChem SID
162240955
24856691
PubChem CID
118503

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
276189 external link Add to cart Please log in.
Data Source Data ID
PubChem 118503 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.6013  LogD (pH = 7.4) 2.6013 
Log P 2.6013  Molar Refractivity 46.8845 cm3
Polarizability 22.826172 Å3 Polar Surface Area 35.53 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Flash Point
35 °C expand Show data source
95 °F expand Show data source
Density
0.903 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.411(lit.) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
UN Number
3272 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
2 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
10-36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H226-H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 3272 3/PG 3 expand Show data source
Purity
99% expand Show data source
Linear Formula
(CH3)3SiOCH2CO2Si(CH3)3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 276189 external link
Packaging
25 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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