Cas no 42875-50-3 (Sodium, (3,3-dimethyl-1-butynyl)-)
42875-50-3 structure
Product Name:Sodium, (3,3-dimethyl-1-butynyl)-
CAS No:42875-50-3
MF:C6H9Na
MW:104.125432729721
CID:324234
PubChem ID:12632398
Update Time:2025-04-19
Sodium, (3,3-dimethyl-1-butynyl)- Chemical and Physical Properties
Names and Identifiers
-
- Sodium, (3,3-dimethyl-1-butynyl)-
- sodium,3,3-dimethylbut-1-yne
- Sodium 3,3-dimethylbut-1-yn-1-ide
- DTXSID80505048
- 42875-50-3
-
- Inchi： 1S/C6H9.Na/c1-5-6(2,3)4;/h2-4H3;/q-1;+1
- InChI Key： GXSFCGHNZOFEQJ-UHFFFAOYSA-N
- SMILES： [Na+].C(C#[C-])(C)(C)C
Computed Properties
- Exact Mass: 104.06019457g/mol
- Monoisotopic Mass: 104.06019457g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 1
- Complexity: 78.1
- 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: 0?2
Sodium, (3,3-dimethyl-1-butynyl)- Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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