Cas no 80866-51-9 (2-Butynoic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, ethyl ester)
![2-Butynoic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/81000/80866-51-9x500.png)
80866-51-9 structure
Product Name:2-Butynoic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, ethyl ester
CAS No:80866-51-9
MF:C12H22O3Si
MW:242.386785030365
CID:704928
PubChem ID:11447879
Update Time:2025-04-19
2-Butynoic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Butynoic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, ethyl ester
- ethyl 4-[tert-butyl(dimethyl)silyl]oxybut-2-ynoate
- SCHEMBL221549
- 80866-51-9
- UZWDBSNNFTYNHN-UHFFFAOYSA-N
- DTXSID90466212
- Ethyl 4-(t-butyldimethylsilyloxy)-2-butynoate
-
- Inchi： 1S/C12H22O3Si/c1-7-14-11(13)9-8-10-15-16(5,6)12(2,3)4/h7,10H2,1-6H3
- InChI Key： UZWDBSNNFTYNHN-UHFFFAOYSA-N
- SMILES： [Si](C)(C)(C(C)(C)C)OCC#CC(=O)OCC
Computed Properties
- Exact Mass: 242.13382109g/mol
- Monoisotopic Mass: 242.13382109g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 301
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 35.5?2
2-Butynoic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, ethyl ester Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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