Cas no 91509-32-9 (Lithium, [3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-propynyl]-)
91509-32-9 structure
Product Name:Lithium, [3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-propynyl]-
CAS No:91509-32-9
MF:C9H17LiOSi
MW:176.257183790207
CID:787436
PubChem ID:11084418
Update Time:2025-04-19
Lithium, [3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-propynyl]- Chemical and Physical Properties
Names and Identifiers
-
- Lithium, [3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-propynyl]-
- lithium,tert-butyl-dimethyl-prop-2-ynoxysilane
- 91509-32-9
- DTXSID60454601
- AGN-PC-0NFMH9
-
- Inchi: 1S/C9H17OSi.Li/c1-7-8-10-11(5,6)9(2,3)4;/h8H2,2-6H3;/q-1;+1
- InChI Key: AYDPHCOMCHHWCK-UHFFFAOYSA-N
- SMILES: [Si](C)(C)(C(C)(C)C)OCC#[C-].[Li+]
Computed Properties
- Exact Mass: 176.12087013g/mol
- Monoisotopic Mass: 176.12087013g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 173
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23000
- LogP: 2.59800
Lithium, [3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-1-propynyl]- Related Literature
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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