Cas no 5781-55-5 (Ethanedioic acid,bimol. monoanhydride, dimethyl ester (9CI))
5781-55-5 structure
Product Name:Ethanedioic acid,bimol. monoanhydride, dimethyl ester (9CI)
Ethanedioic acid,bimol. monoanhydride, dimethyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Ethanedioic acid,bimol. monoanhydride, dimethyl ester (9CI)
- 2,5,8-trioxanonane-3,4,6,7-tetrone
- 2-O-(2-methoxy-2-oxoacetyl) 1-O-methyl oxalate
- AC1L2Y9X
- AC1Q5YPL
- AG-G-04334
- AR-1J4201
- CTK5A7489
- EINECS 227-309-5
- methoxalic anhydride
- Methoxalsaeureanhydrid
- methoxy(oxo)acetic anhydride
- NSC141023
- Oxalsaeuremonomethylester-anhydrid
- Oxalsaeure-monomethylester-anhydrid
- DTXSID00206520
- UNII-HZR9F2TR2J
- NSC 141023
- NS00033796
- HZR9F2TR2J
- NSC-141023
- 5781-55-5
-
- Inchi： 1S/C6H6O7/c1-11-3(7)5(9)13-6(10)4(8)12-2/h1-2H3
- InChI Key： JKFKZGGSAYSSBN-UHFFFAOYSA-N
- SMILES： O(C(C(=O)OC)=O)C(C(=O)OC)=O
Computed Properties
- Exact Mass: 190.01128
- Monoisotopic Mass: 190.011353
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 13
- Rotatable Bond Count: 6
- Complexity: 228
- 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: 96
Experimental Properties
- Density: 1.406
- Boiling Point: 242.3°Cat760mmHg
- Flash Point: 101.6°C
- Refractive Index: 1.434
- PSA: 95.97
Ethanedioic acid,bimol. monoanhydride, dimethyl ester (9CI) Related Literature
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
5781-55-5 (Ethanedioic acid,bimol. monoanhydride, dimethyl ester (9CI)) Related Products
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