Cas no 89587-71-3 (Propanedioic acid, (ethoxymethylene)-, bis(1-methylethyl) ester)
89587-71-3 structure
Product Name:Propanedioic acid, (ethoxymethylene)-, bis(1-methylethyl) ester
CAS No:89587-71-3
MF:C12H20O5
MW:244.284204483032
CID:595600
PubChem ID:20271254
Update Time:2025-04-19
Propanedioic acid, (ethoxymethylene)-, bis(1-methylethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, (ethoxymethylene)-, bis(1-methylethyl) ester
- dipropan-2-yl 2-(ethoxymethylidene)propanedioate
- 89587-71-3
- DTXSID20604428
- Diisopropyl(ethoxymethylene)malonate
- Dipropan-2-yl (ethoxymethylidene)propanedioate
- VLQFGQDSWBZCHS-UHFFFAOYSA-N
- SCHEMBL3328433
-
- Inchi： 1S/C12H20O5/c1-6-15-7-10(11(13)16-8(2)3)12(14)17-9(4)5/h7-9H,6H2,1-5H3
- InChI Key： VLQFGQDSWBZCHS-UHFFFAOYSA-N
- SMILES： O(C(/C(=C\OCC)/C(=O)OC(C)C)=O)C(C)C
Computed Properties
- Exact Mass: 244.13107373g/mol
- Monoisotopic Mass: 244.13107373g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 267
- 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: 2.4
- Topological Polar Surface Area: 61.8?2
Propanedioic acid, (ethoxymethylene)-, bis(1-methylethyl) ester Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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