1-[(Trimethylsilyl)ethynyl]-4-(trifluoromethyl)benzene - CAS 40230-95-3
Catalog: |
BB024380 |
Product Name: |
1-[(Trimethylsilyl)ethynyl]-4-(trifluoromethyl)benzene |
CAS: |
40230-95-3 |
Synonyms: |
trimethyl-[2-[4-(trifluoromethyl)phenyl]ethynyl]silane |
IUPAC Name: | trimethyl-[2-[4-(trifluoromethyl)phenyl]ethynyl]silane |
Description: | 1-[(Trimethylsilyl)ethynyl]-4-(trifluoromethyl)benzene (CAS# 40230-95-3 ) is a useful research chemical. |
Molecular Weight: | 242.31 |
Molecular Formula: | C12H13F3Si |
Canonical SMILES: | C[Si](C)(C)C#CC1=CC=C(C=C1)C(F)(F)F |
InChI: | InChI=1S/C12H13F3Si/c1-16(2,3)9-8-10-4-6-11(7-5-10)12(13,14)15/h4-7H,1-3H3 |
InChI Key: | FHGNUAFFHLVAJP-UHFFFAOYSA-N |
Boiling Point: | 80 °C / 0.1 mmHg (lit.) |
Density: | 1.029 g/mL at 25 °C(lit.) |
MDL: | MFCD03427266 |
LogP: | 3.93430 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111211355-A | High-voltage lithium ion battery electrolyte additive, electrolyte and battery thereof | 20200115 |
CN-107459438-B | Novel practical nonmetal-catalyzed silica-based deprotection method | 20170701 |
CN-109843861-A | Photoinitiator with protected carbonyl group | 20161020 |
US-2019248757-A1 | Photoinitiators with protected carbonyl group | 20161020 |
US-10968197-B2 | Photoinitiators with protected carbonyl group | 20161020 |
PMID | Publication Date | Title | Journal |
21517057 | 20110603 | Tetrabutylammonium fluoride (TBAF)-catalyzed addition of substituted trialkylsilylalkynes to aldehydes, ketones, and trifluoromethyl ketones | The Journal of organic chemistry |
Complexity: | 292 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 242.07386144 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 242.07386144 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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