Cas no 24297-12-9 (2-propyn-1-ol, 1,1-dicyclopropyl-,)
24297-12-9 structure
Product Name:2-propyn-1-ol, 1,1-dicyclopropyl-,
2-propyn-1-ol, 1,1-dicyclopropyl-, Chemical and Physical Properties
Names and Identifiers
-
- 2-propyn-1-ol, 1,1-dicyclopropyl-,
- 1,1-dicyclopropylprop-2-yn-1-ol
- AKOS024430097
- 6662-40-4
- DTXSID30334249
- DA-07767
- 1,1-DICYCLOPROPYL-PROP-2-YN-1-OL
- SCHEMBL1993857
- 1,1-Dicyclopropylpropyn-1-o1
- OXBOSLIINGKALV-UHFFFAOYSA-N
- 24297-12-9
-
- Inchi： 1S/C9H12O/c1-2-9(10,7-3-4-7)8-5-6-8/h1,7-8,10H,3-6H2
- InChI Key： OXBOSLIINGKALV-UHFFFAOYSA-N
- SMILES： OC(C#C)(C1CC1)C1CC1
Computed Properties
- Exact Mass: 136.08886
- Monoisotopic Mass: 136.088815002g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 178
- 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
- XLogP3: 1
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
2-propyn-1-ol, 1,1-dicyclopropyl-, Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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