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3-(Trimethylsilyl)propargyl alcohol

3-(Trimethylsilyl)propargyl alcohol - CAS 5272-36-6

Catalog:	BB027920
Product Name:	3-(Trimethylsilyl)propargyl alcohol
CAS:	5272-36-6
Synonyms:	3-trimethylsilylprop-2-yn-1-ol

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	3-trimethylsilylprop-2-yn-1-ol
Description:	3-(Trimethylsilyl)propargyl alcohol (CAS# 5272-36-6) is used as a reagent to synthesize Isbogrel, a Thromboxane A 2 (TXA 2) synthase inhibitor and also a TXA 2 receptor antagonist that has potential to treat asthma.
Molecular Weight:	128.24
Molecular Formula:	C6H12OSi
Canonical SMILES:	C[Si](C)(C)C#CCO
InChI:	InChI=1S/C6H12OSi/c1-8(2,3)6-4-5-7/h7H,5H2,1-3H3
InChI Key:	ZVGCJDPEKKEYES-UHFFFAOYSA-N
Boiling Point:	76 °C (20 mmHg)
Density:	0.865 g/cm³
MDL:	MFCD00002913
LogP:	0.85950

Publication Number	Title	Priority Date
US-2021174983-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
WO-2021112933-A1	Compositions for the filling of high aspect ratio vertical interconnect access (via) holes	20191204
US-2021054003-A1	Methods for the preparation of cyclopentaoxasilinones and cyclopentaoxaborininones and their use	20190820
WO-2020223672-A1	Functionalized cyclic polymers and methods of preparing same	20190501
WO-2019220764-A1	Electrolyte, electrochemical device, lithium-ion secondary battery, and module	20180514

PMID	Publication Date	Title	Journal
22220113	20111101	3-(Trimethyl-sil-yl)prop-2-ynyl p-toluene-sulfonate	Acta crystallographica. Section E, Structure reports online
17907128	20071105	Synthesis of spirocyclic C-arylglycosides and -ribosides by ruthenium-catalyzed cycloaddition	Chemistry, an Asian journal
16869661	20060803	Synthesis of spirocyclic C-arylribosides via cyclotrimerization	Organic letters

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Related Functional Groups

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Alkynes

[1066-54-2]
Ethynyltrimethylsilane
[627-41-8]
Methyl propargyl ether
[15430-52-1]
Propargylamine hydrochloride
[1189377-77-2]
1,2-bis(4-(pyridin-4-yl)phenyl)ethyne
[2132-62-9]
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[17156-64-8]
(Dimethylphenylsilyl)acetylene

GHS Hazard Statement:	H227 (20%): Combustible liquid [Warning Flammable liquids]
Precautionary Statement:	P210, P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	120
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	128.065741536
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	128.065741536
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0