3-[(Trimethylsilyl)ethynyl]pyridine - CAS 80673-00-3

Catalog:	BB036535
Product Name:	3-[(Trimethylsilyl)ethynyl]pyridine
CAS:	80673-00-3
Synonyms:	trimethyl(2-pyridin-3-ylethynyl)silane

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	trimethyl(2-pyridin-3-ylethynyl)silane
Description:	3-[(Trimethylsilyl)ethynyl]pyridine (CAS# 80673-00-3) is a useful research chemical.
Molecular Weight:	175.30
Molecular Formula:	C10H13NSi
Canonical SMILES:	C[Si](C)(C)C#CC1=CN=CC=C1
InChI:	InChI=1S/C10H13NSi/c1-12(2,3)8-6-10-5-4-7-11-9-10/h4-5,7,9H,1-3H3
InChI Key:	MTMBLPOPETZZRX-UHFFFAOYSA-N
Boiling Point:	229 °C
Purity:	> 98.0 % (GC)
Density:	0.922 g/cm³
Appearance:	Transparent liquid
Storage:	Freezer
MDL:	MFCD01863744
LogP:	2.31050

Publication Number	Title	Priority Date
CN-111416154-A	Silicon-based pyridine additive for high-voltage lithium ion battery electrolyte, electrolyte and battery	20200522
CN-111416154-B	Silicon-based pyridine additive for high-voltage lithium ion battery electrolyte, electrolyte and battery	20200522
CN-111285873-A	RET inhibitors, pharmaceutical compositions thereof and uses thereof	20181207
CN-111285874-A	RET inhibitors, pharmaceutical compositions thereof and uses thereof	20181207
WO-2020114487-A1	Ret inhibitors, pharmaceutical compositions and uses thereof	20181207

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Related Functional Groups

Pyridines

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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:	203
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	175.081725953
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	175.081725953
Rotatable Bond Count:	2
Topological Polar Surface Area:	12.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0