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2-[(Trimethylsilyl)ethynyl]aniline

2-[(Trimethylsilyl)ethynyl]aniline - CAS 103529-16-4

Catalog:	BB001168
Product Name:	2-[(Trimethylsilyl)ethynyl]aniline
CAS:	103529-16-4
Synonyms:	2-(2-trimethylsilylethynyl)aniline

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Computed Properties

IUPAC Name:	2-(2-trimethylsilylethynyl)aniline
Description:	2-[(Trimethylsilyl)ethynyl]aniline (CAS# 103529-16-4 ) is a useful research chemical.
Molecular Weight:	189.33
Molecular Formula:	C11H15NSi
Canonical SMILES:	C[Si](C)(C)C#CC1=CC=CC=C1N
InChI:	InChI=1S/C11H15NSi/c1-13(2,3)9-8-10-6-4-5-7-11(10)12/h4-7H,12H2,1-3H3
InChI Key:	ISXSBRZDPKQYSC-UHFFFAOYSA-N
Boiling Point:	120 °C0.1 mmHg (lit.)
Purity:	95 %
Density:	0.94 g/mL at 25 °C(lit.)
Appearance:	Colorless to pale yellow liquid
Storage:	Keep in dark place, Sealed in dry, 2-8 °C
MDL:	MFCD02093646
LogP:	3.07890

Publication Number	Title	Priority Date
WO-2020223672-A1	Functionalized cyclic polymers and methods of preparing same	20190501
CN-107459438-B	Novel practical nonmetal-catalyzed silica-based deprotection method	20170701
EP-3628103-A1	Nonaqueous electrolyte, nonaqueous electrolyte energy storage device, and method for producing nonaqueous electrolyte energy storage device	20170606
JP-2018206642-A	Non-aqueous electrolyte, non-aqueous electrolyte storage element, and method for manufacturing non-aqueous electrolyte storage element	20170606
WO-2018224286-A1	Nonaqueous electrolyte, nonaqueous electrolyte energy storage device, and method for producing nonaqueous electrolyte energy storage device	20170606

PMID	Publication Date	Title	Journal
19518068	20090702	Zinc-catalyzed reactions of ethenetricarboxylates with 2-(trimethylsilylethynyl)anilines leading to bridged quinoline derivatives	Organic letters

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	228
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.097376017
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	189.097376017
Rotatable Bond Count:	2
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0