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tert-Butyldimethyl(2-propynyloxy)silane

tert-Butyldimethyl(2-propynyloxy)silane - CAS 76782-82-6

Catalog:	BB035698
Product Name:	tert-Butyldimethyl(2-propynyloxy)silane
CAS:	76782-82-6
Synonyms:	tert-butyl-dimethyl-prop-2-ynoxysilane

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Computed Properties

IUPAC Name:	tert-butyl-dimethyl-prop-2-ynoxysilane
Description:	An alkyne used in organinc synthesis.
Molecular Weight:	170.32
Molecular Formula:	C9H18OSi
Canonical SMILES:	CC(C)(C)[Si](C)(C)OCC#C
InChI:	InChI=1S/C9H18OSi/c1-7-8-10-11(5,6)9(2,3)4/h1H,8H2,2-6H3
InChI Key:	ZYDKYFIXEYSNPO-UHFFFAOYSA-N
Boiling Point:	157.8 °C at 760 mmHg
Purity:	97 %
Density:	0.838 g/cm³
MDL:	MFCD01863574
LogP:	2.64140

Publication Number	Title	Priority Date
WO-2021188696-A1	Stat degraders and uses thereof	20200317
WO-2021185256-A1	Substituted pyrimidine or pyridine amine derivative, composition thereof, and medical use thereof	20200316
WO-2021163727-A1	Pikfyve kinase inhibitors	20200211
CN-111187292-A	Method for synthesizing Î± -vinyl silane under heterogeneous condition	20200109
CN-111187292-B	Method for synthesizing alpha-vinyl silane under heterogeneous condition	20200109

PMID	Publication Date	Title	Journal
15303325	20040601	Chiral synthesis of (Z)-3-cis-6,7-cis-9,10-diepoxyhenicosenes, sex pheromone components of the satin moth, Leucoma salicis	Journal of chemical ecology

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P264, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P313, P337+P313, P362, P370+P378, P403+P235, and P501
Signal Word:	Warning

Complexity:	168
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	170.112691728
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	170.112691728
Rotatable Bond Count:	3
Topological Polar Surface Area:	9.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0