Cas no 5465-07-6 ( )
structure
Product Name:
Chemical and Physical Properties
Names and Identifiers
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- CTK1H2554; SureCN2430959; 2-[1,3]dioxan-2-yl-ethanol; AC1L5MV5; NSC28940; AR-1C6012; AC1Q7CM4; 2-hydroxyethyl1,3-dioxane; AKOS015818234; 2-hydroxyethyl-1,3-dioxane; 2-[1,3]Dioxan-2-yl-aethanol; MW 132 acetal;
- NSC-28940
- 2-(1,3-dioxan-2-yl)ethan-1-ol
- AKOS015818234
- DTXSID10282951
- LYTNHFVPHUPKGE-UHFFFAOYSA-N
- 5465-07-6
- 2-(1,3-dioxan-2-yl)ethanol
- 1,3-Dioxane-2-ethanol
- DB-132383
- SCHEMBL2430959
- NSC28940
- 2-(2'-hydroxyethyl)-1,3-dioxane
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- Inchi： 1S/C6H12O3/c7-3-2-6-8-4-1-5-9-6/h6-7H,1-5H2
- InChI Key： LYTNHFVPHUPKGE-UHFFFAOYSA-N
- SMILES： O1CCCOC1CCO
Computed Properties
- Exact Mass: 132.07866
- Monoisotopic Mass: 132.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 68.7
- 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: -0.1
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.69
Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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