Cas no 74965-86-9 (1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(2-methyl-1-oxopropyl)-)
74965-86-9 structure
Product Name:1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(2-methyl-1-oxopropyl)-
CAS No:74965-86-9
MF:C10H14O5
MW:214.215163707733
CID:540234
PubChem ID:12425377
Update Time:2025-04-19
1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(2-methyl-1-oxopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(2-methyl-1-oxopropyl)-
- 2,2-dimethyl-5-(2-methylpropanoyl)-1,3-dioxane-4,6-dione
- 74965-86-9
- DTXSID40497672
- SCHEMBL1403061
-
- Inchi： 1S/C10H14O5/c1-5(2)7(11)6-8(12)14-10(3,4)15-9(6)13/h5-6H,1-4H3
- InChI Key： MVOOKWYIOZFMJP-UHFFFAOYSA-N
- SMILES： O1C(C(C(=O)OC1(C)C)C(C(C)C)=O)=O
Computed Properties
- Exact Mass: 214.08412
- Monoisotopic Mass: 214.08412354g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 296
- 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: 1.6
- Topological Polar Surface Area: 69.7?2
Experimental Properties
- PSA: 69.67
1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(2-methyl-1-oxopropyl)- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
74965-86-9 (1,3-Dioxane-4,6-dione, 2,2-dimethyl-5-(2-methyl-1-oxopropyl)-) Related Products
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