Tri(isopropyl)silyl acrylate CAS#: 157859-20-6; ChemWhat Code: 1489680

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

Product NameTri(isopropyl)silyl acrylate
IUPAC Nametri(propan-2-yl)silyl prop-2-enoate
Molecular Structure
CAS Registry Number 157859-20-6
EINECS NumberNo data available
MDL NumberMFCD01861733
Beilstein Registry NumberNo data available
Synonymstriisopropylsilyl acrylate
157859-20-6
tri(propan-2-yl)silyl prop-2-enoate
Triisopropylsilylacrylate
acryloxytriisopropylsilane
Tri(isopropyl)silyl acrylate
Tri-isopropyl silyl acrylate
2-Propenoic acid, tris(1-methylethyl)silyl ester
TIPSA
2-Propenoic acid,tris(1-methylethyl)silyl ester
Acrylic acid triisopropylsilyl ester
tris(propan-2-yl)silyl prop-2-enoate
EC 457-670-6
SCHEMBL475926
DTXSID10166323
AMY42279
BCP11432
MFCD01861733
AKOS015904494
FS-6134
TRIISOPROPYLSILYL PROP-2-ENOATE
DB-318560
CS-0006219
NS00077829
T3789
Triisopropylsilyl Acrylate (Stabilized With Bht)
A883472
J-510289
Molecular FormulaC12H24O2Si
Molecular Weight228.40
InChIInChI=1S/C12H24O2Si/c1-8-12(13)14-15(9(2)3,10(4)5)11(6)7/h8-11H,1H2,2-7H3
InChI KeyPQSIXYSSKXAOFE-UHFFFAOYSA-N
Canonical SMILESCC(C)[Si](C(C)C)(C(C)C)OC(=O)C=C
Patent Information
Patent IDTitlePublication Date
JP2016/216437DISTILLATION METHOD FOR UNSATURATED CARBOXYLIC ACID SILYL ESTER2016
EP1431301Process for the production of silyl carboxylate monomers2004

Physical Data

AppearanceColorless clear liquid
Solubility60-1000000mg/L at 20-25℃
Refractive index1.4485
Sensitivityreacts slowly with moisture/water
Boiling Point, °CPressure (Boiling Point), Torr
96 – 10210
876

Spectra

Description (NMR Spectroscopy)Nucleus (NMR Spectroscopy)Solvents (NMR Spectroscopy)Frequency (NMR Spectroscopy), MHzOriginal Text (NMR Spectroscopy)
Chemical shifts1Hchloroform-d1400
Chemical shifts13Cchloroform-d1100
13Cchloroform-d113C NMR: 132.5, 130.4, 175.0, 12.3, 17.0
29Sichloroform-d129Si NMR: 21.84
Description (IR Spectroscopy)Solvent (IR Spectroscopy)Original Text (IR Spectroscopy)
Bands, Spectrumpotassium bromide
FilmIR (film): 2948, 2870, 1708, 1620, 1465, 1403, 1290, 1209, 1046, 884, 818, 746 cm-1

Route of Synthesis (ROS)

Route of Synthesis (ROS) of Tri(isopropyl)silyl acrylate CAS 157859-20-6
ConditionsYield
With 4-methoxy-phenol; tetrabutyl ammonium fluoride In n-heptane at 125 – 130℃; under 760.051 Torr; Azeotropic distillation;

Safety and Hazards

Pictogram(s)exclamation-markenvironment
SignalWarning
GHS Hazard StatementsH315 (12.5%): Causes skin irritation [Warning Skin corrosion/irritation]
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
H400 (41.67%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
H410 (41.67%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
H411 (12.5%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Information may vary between notifications depending on impurities, additives, and other factors.
Precautionary Statement CodesP261, P264, P272, P273, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, P391, and P501
(The corresponding statement to each P-code can be found at the GHS Classification page.)

Other Data

TransportationClass 9; Packaging Group: III; UN Number: 3082
Under the room temperature and away from light
HS Code293190
StorageUnder the room temperature and away from light
Shelf Life2 year
Market PriceUSD
SDS DownloadEnglish Version
Druglikeness
Lipinski rules component
Molecular Weight228.407
logP4.114
HBA2
HBD0
Matching Lipinski Rules4
Veber rules component
Polar Surface Area (PSA)26.3
Rotatable Bond (RotB)6
Matching Veber Rules2
Use Pattern
Tri(isopropyl)silyl acrylate CAS#: 157859-20-6 used as resin monomer to make new antifouling coatings for marine ships.

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