Sodium tert-butoxide solution - 2 M in THF , CAS No.865-48-5

CAS: 865-48-5 Cat. No.: S140748 Molecular Weight: 96.1 EC Number: 212-741-9 PubChem CID: 23676156

GRADE & PURITY 2 M in THF

Synonyms

2-Propanol, 2-methyl-, sodium salt (1:1) | EC 212-741-9 | t-butoxysodium | (tert-butoxy)sodium | tertiary butoxy sodium | SH-003 | sodium tbutoxide | sodium t-butoxide | Sodium tert-butoxide, 97% | tert-butyl 4-formylpiperidine-1-carboxylate;N-BOC-PIPERID

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

2-Propanol, 2-methyl-, sodium salt (1:1) | EC 212-741-9 | t-butoxysodium | (tert-butoxy)sodium | tertiary butoxy sodium | SH-003 | sodium tbutoxide | sodium t-butoxide | Sodium tert-butoxide, 97% | tert-butyl 4-formylpiperidine-1-carboxylate;N-BOC-PIPERID

Specifications & Purity

2 M in THF

Storage

Argon charged, Room temperature

Shipped In

Normal

Names and Identifiers

• Canonical Smiles: CC(C)(C)[O-].[Na+]
• IUPAC Name: sodium;2-methylpropan-2-olate
• InChIKey: MFRIHAYPQRLWNB-UHFFFAOYSA-N
• INCHI: 1S/C4H9O.Na/c1-4(2,3)5;/h1-3H3;/q-1;+1
• Isomeric SMILES: CC(C)(C)[O-].[Na+]
• WGK Germany: 3
• PubChem CID: 23676156
• Molecular Weight: 96.1

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • Class Organic metal salts
      • Subclass Organic alkali metal salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• Class: Organic metal salts
• Subclass: Organic alkali metal salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic alkali metal salts
• Alternative Parents: Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Alkoxides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic alkali metal salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic zwitterion - Alkoxide - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organic alkali metal salts. These are organic salts of an alkali metal. The alkali metal atom is usually in its ionic form.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Sensitivity: Moisture sensitive；Air sensitive
• Refractive Index: 1.413
• Flash Point(°F): 57.2 °F
• Flash Point(°C): 14 °C
• Melt Point(°C): 270 °C
• Molecular Weight: 96.100 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 96.0551 Da
• Monoisotopic Mass: 96.0551 Da
• Topological Polar Surface Area: 23.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 29.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

References

1. Yuying Li, Junle Zhang, Yaxuan Shi, Yuancheng Zhang, Ge Shi, Xiaomeng Zhang, Zhe Cui, Peng Fu, Minying Liu, Xiaoguang Qiao, Yanjie He, Yudong Wang, Haitao Zhao, Wenjie Zhang, Xinchang Pang.  (2023)  Robust Strategy to Improve the Compatibility between Incorporated Upconversion Nanoparticles and the Bulk Transparent Polymer Matrix.  ACS Omega,      [PMID:37692212] [10.1021/acsomega.3c04613]

2. Duanlian Tang, Minlei Yin, Xiaowei Du, Yuxin Duan, Jie Chen, Ting Qiu.  (2023)  Wettability tunable conjugated microporous poly(aniline)s for long-term, rapid and ppb level sequestration of Hg(II).  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.145527]

3. Duanlian Tang, Xiaoying Lyu, Zhixian Huang, Renwei Xu, Jie Chen, Ting Qiu.  (2023)  Nitrogen-doped microporous carbons as highly efficient adsorbents for CO2 and Hg(II) capture.  POWDER TECHNOLOGY,      [PMID:] [10.1016/j.powtec.2023.118769]

4. Xiaoyu Lou, Xiaoyan Chen, Duanlian Tang, Qiong Wang, Yukun Tian, Menghan Tu, Yupeng Wang, Changshen Ye, Jie Chen, Ting Qiu.  (2022)  Conjugated Microporous Poly(aniline) Enabled Hierarchical Porous Carbons for Hg(II) Adsorption.  LANGMUIR,      [PMID:36260748] [10.1021/acs.langmuir.2c02240]

5. Hang Yu, Dewang Li, Huayu Bao, Zhenhu Zhang, Hongli Liu, Fei Zhang, Shirong Wang.  (2022)  Multifunctional Cross-Linked Hole Transporting Interfacial Layer for Efficient and Stable Perovskite Solar Cells.  ACS Applied Energy Materials,      [PMID:] [10.1021/acsaem.2c01470]

6. Tao Huang, Rongrong Zheng, Haiyang Chang, Di Ma, Haijun Niu.  (2022)  Sodium tert-butoxide as stable electrode material in aprotic electrolyte for high cycle stability organic sodium-ion batteries.  JOURNAL OF POWER SOURCES,      [PMID:] [10.1016/j.jpowsour.2022.231361]

7. Xianqi Zhu, Lin Li, Jin Tang, Chunyu Yang, Hao Yu, Kunpeng Liu, Ziyan Zheng, Xinggui Gu, Qingsong Yu, Fu-Jian Xu, Zhihua Gan.  (2021)  Cascade-responsive nano-assembly for efficient photothermal-chemo synergistic inhibition of tumor metastasis by targeting cancer stem cells.  BIOMATERIALS,      [PMID:34890970] [10.1016/j.biomaterials.2021.121305]

8. Yan-Xiong LIU, Long-Chun BIAN, Jie-Ren XIA, Qiu-E CAO.  (2021)  A Novel Ion-imprinted Polymer Based on Multi-walled Carbon Nanotubes for Solid Phase Extraction of Pd(II).  CHINESE JOURNAL OF ANALYTICAL CHEMISTRY,      [PMID:] [10.1016/S1872-2040(21)60114-7]

9. Jian Chen, Kai Chen, Baichuan Han, Yunting Xue, Wanjuan Chen, Zhenzhong Gao, Xianfeng Hou.  (2020)  A novel single-fluorophore-based ratiometric fluorescent probe for detection of formaldehyde in air.  TETRAHEDRON,      [PMID:] [10.1016/j.tet.2020.131681]

10. Yue Yu, Lei Shi, Jianjun Guo, Xin Li, Wenbing Yang, Zhigang Zhang, Guangwen Xu.  (2020)  In-depth understanding of soluble base deactivation during the carbonate transesterification process.  FUEL,      [PMID:] [10.1016/j.fuel.2020.119201]

11. Zifeng Yang, Lei Liu, Hongzhe An, Chenhao Li, Zhencai Zhang, Wenjuan Fang, Fei Xu, Suojiang Zhang.  (2020)  Cost-Effective Synthesis of High Molecular Weight Biobased Polycarbonate via Melt Polymerization of Isosorbide and Dimethyl Carbonate.  ACS Sustainable Chemistry & Engineering,      [PMID:] [10.1021/acssuschemeng.0c00430]

12. Xinming Wu, Bin Huang, Qiguan Wang, Yan Wang.  (2019)  Thermally chargeable supercapacitor using a conjugated conducting polymer: Insight into the mechanism of charge-discharge cycle.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2019.05.075]

13. S. B. Tan, Y. F. Zhao, W. W. Zhang, P. Gao, W. W. Zhu, Z. C. Zhang.  (2017)  A light-mediated metal-free atom transfer radical chain transfer reaction for the controlled hydrogenation of poly(vinylidene fluoride-chlorotrifluoroethylene).  Polymer Chemistry,  9  (2): (221-227).  [PMID:] [10.1039/C7PY01870C]

14. Xue-Qi Zhang, Zhong-Xia Wang.  (2013)  Nickel-catalyzed cross-coupling of aryltrimethylammonium triflates and amines.  ORGANIC & BIOMOLECULAR CHEMISTRY,  12  (9): (1448-1453).  [PMID:24445564] [10.1039/C3OB41989D]

15. Long Tian, Xiaonan Song, Yi Liu, Churu Zhang, Lan Shi, Qinglin Chen, Yanyan Deng, Weigang Cui, Shaoyun Shan, Tianding Hu.  (2024)  Defect-engineering improves the activity of Metal-Organic frameworks for catalyzing hydroboration of Alkynes: A combination of experimental investigation and Density functional theory calculations.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:38354554] [10.1016/j.jcis.2024.02.067]

16. Xiaoming Li, Kun Li, Wei Zhao, Qiuhong Ouyang, Jimin Guo, Jianjun Zhang.  (2024)  Hollow Prussian Blue Nanoparticle-Based Controlled-Release Nanocapsules for Enhanced Tumor Antiangiogenesis Therapy.  ACS Applied Nano Materials,      [PMID:] [10.1021/acsanm.4c05425]

17. Xiaoyu Lou, Duanlian Tang, Xuanjie Chen, Lanbin Mo, Yong Li, Changshen Ye, Jie Chen, Ting Qiu.  (2024)  Ketone-based conjugated microporous poly(aniline)s for the ultradeep separation of heavy metal ions.  CHEMICAL ENGINEERING SCIENCE,      [PMID:] [10.1016/j.ces.2024.120706]

18. Jie Chen, Wen Zeng, Huiyao Huang, Xiaoyu Lou, Song Chen, Changshen Ye, Zhixian Huang, Ting Qiu.  (2025)  Tunable porosity and Hg (II) adsorption performance in dual heteroatom functionalized conjugated micro-mesoporous poly(aniline)s.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2025.131997]

19. Hongyang Li, Xiaopeng Zhang, Meimei Zhu, Dongwen Zou, Jingyan Liu, Meili Xu, Yaowu He, Hong Meng.  (2025)  All-Solid-State Transparent-to-Black Electrochromic Smart Window for Building Energy Saving.  ACS Energy Letters,      [PMID:] [10.1021/acsenergylett.5c01557]

20. Yang Yujie, Wang Jiaqiang, Yang Jie, Tong Lihuan, Cui Xiaodan, Fang Manman, Li Zhen.  (2025)  Constructing an auto triplet excitons supply system for photogenerated radicals in the solid state.  Nature Communications,  16  (1): (1-13).  [PMID:40993114] [10.1038/s41467-025-61353-5]

21. Jingtao An, Wanan Cai, Wenbin Zheng, Zixiang Zheng, Xuewen Ming, Haijun Niu, Wen Wang.  (2025)  High-contrast electrochromic nano fiber films changing from yellow-green to black based on butterfly monomer for smart windows and self-adaptive camouflage.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:40245835] [10.1016/j.jcis.2025.137559]

22. Lihuan Xu, Shutong Liu, Huisheng Liu, Chang Su.  (2025)  Preparation of polytriphenylamine derivative containing imine electroactive structure and its electrochemical performance as the organic cathode of lithium ion batteries.  ELECTROCHIMICA ACTA,      [PMID:] [10.1016/j.electacta.2025.146481]

23. Xiaoying Lin, Bingqing Huang, Yifan Liu, Yuancai Lv, Chunxiang Lin, Jianhui Huang, Minghua Liu, Xiaoxia Ye, Jie Chen.  (2025)  Efficient adsorption of U(VI) from seawater on tannin-immobilized conjugated micro-mesoporous poly(aniline)s.  DESALINATION,      [PMID:] [10.1016/j.desal.2025.119593]

24. Hongyang Li, Yaowu He, Dongwen Zou, Meili Xu, Jingyan Liu, Zizheng Tong, Meimei Zhu, Jinyuan Tang, Tianhe Xu, Lijia Yan, Hong Meng.  (2025)  Smart energy-saving windows enabled by transparent-to-black ultra-low voltage polytriphenylamines.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.170887]

25. Yu Fang, Qi Shi, Jinping Qu, Xiang Lu.  (2026)  Single molecule coupling of light and thermal for programmable energy storage.  POLYMER,      [PMID:] [10.1016/j.polymer.2026.129684]

26. Bingqing Huang, Xiaoying Lin, Yifan Liu, Yuancai Lv, Chunxiang Lin, Liang Song, Jianhui Huang, Minghua Liu, Guifang Yang, Xiaoxia Ye.  (2026)  Green synthesis of sulfonated conjugated microporous polyaniline/collagen fiber composites for efficient and sustainable seawater uranium extraction.  CHEMICAL ENGINEERING SCIENCE,      [PMID:] [10.1016/j.ces.2026.123600]

27. Gulraiz Tanvir, Kamran Amin, Zhixiang Wei.  (2026)  Bridging Energy and Power Density Gap: Multi-Redox CMP/CNT Composite as High Loading Organic Cathode for Lithium-Ion Battery.  Small Methods,      [PMID:41691393] [10.1002/smtd.202502090]