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1-[(Trimethylsilyl)ethynyl]-3,5-dimethoxybenzene

1-[(Trimethylsilyl)ethynyl]-3,5-dimethoxybenzene - CAS 400608-30-2

Catalog:	BB024274
Product Name:	1-[(Trimethylsilyl)ethynyl]-3,5-dimethoxybenzene
CAS:	400608-30-2
Synonyms:	2-(3,5-dimethoxyphenyl)ethynyl-trimethylsilane

Technical Data

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Computed Properties

IUPAC Name:	2-(3,5-dimethoxyphenyl)ethynyl-trimethylsilane
Description:	1-[(Trimethylsilyl)ethynyl]-3,5-dimethoxybenzene (CAS# 400608-30-2 ) is a useful research chemical.
Molecular Weight:	234.37
Molecular Formula:	C13H18O2Si
Canonical SMILES:	COC1=CC(=CC(=C1)C#C[Si](C)(C)C)OC
InChI:	InChI=1S/C13H18O2Si/c1-14-12-8-11(6-7-16(3,4)5)9-13(10-12)15-2/h8-10H,1-5H3
InChI Key:	DGSBDARVIGVKSP-UHFFFAOYSA-N
Boiling Point:	300.4 °C at 760 mmHg
Density:	0.99 g/cm³
MDL:	MFCD04039978
LogP:	2.93270

Publication Number	Title	Priority Date
WO-2020223672-A1	Functionalized cyclic polymers and methods of preparing same	20190501
TW-201938538-A	Alkynyl-substituted heterocyclic compound, preparation method therefor and medical use therefor for effectively treating and/or preventing FGFR-related diseases such as tumors	20180316
AU-2017327954-A1	Alkynyl-substituted heterocyclic compound, preparation method therefor and medical use thereof	20160919
CA-3036594-A1	Alkynyl-substituted heterocyclic compound, preparation method therefor and medical use thereof	20160919
EP-3517535-A1	Alkynyl-substituted heterocyclic compound, preparation method therefor and medical use thereof	20160919

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Complexity:	269
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	234.107606347
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	234.107606347
Rotatable Bond Count:	4
Topological Polar Surface Area:	18.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0