Cas no 68572-78-1 (diethyl [4R-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate)
![diethyl [4R-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate structure](https://ossimg.kuujia.com/scimg/69000/68572-78-1x500.png)
68572-78-1 structure
Product Name:diethyl [4R-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate
CAS No:68572-78-1
MF:C12H20O6
MW:260.283604621887
CID:971348
Update Time:2023-11-19
diethyl [4R-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate Chemical and Physical Properties
Names and Identifiers
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- diethyl [4R-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate
- Diethyl (4R-(2alpha,4alpha,5beta))-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate
- (4R)-2beta-Ethyl-2-methyl-1,3-dioxolane-4beta,5alpha-dicarboxylic acid diethyl ester
- Diethyl[4r-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate
- CID 90474853
- (4R)-2β-Ethyl-2-methyl-1,3-dioxolane-4β,5α-dicarboxylic acid diethyl ester
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- Inchi： 1S/C12H20O6/c1-5-12(4)17-8(10(13)15-6-2)9(18-12)11(14)16-7-3/h8-9H,5-7H2,1-4H3/t8-,9-/m1/s1
- InChI Key： AYFLBJXOABTRSI-RKDXNWHRSA-N
- SMILES： O1[C@@H](C(=O)OCC)[C@H](C(=O)OCC)OC1(C)CC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 7
- Complexity: 288
- Topological Polar Surface Area: 71.1
diethyl [4R-(2alpha,4alpha,5beta)]-2-ethyl-2-methyl-1,3-dioxolane-4,5-dicarboxylate Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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