Cas no 833447-40-8 (2-Butenedioic acid, 2,3-dicyano-, bis[2-(acetyloxy)ethyl] ester, (2E)-)
![2-Butenedioic acid, 2,3-dicyano-, bis[2-(acetyloxy)ethyl] ester, (2E)- structure](https://ossimg.kuujia.com/scimg/833500/833447-40-8x500.png)
833447-40-8 structure
Product Name:2-Butenedioic acid, 2,3-dicyano-, bis[2-(acetyloxy)ethyl] ester, (2E)-
CAS No:833447-40-8
MF:C14H14N2O8
MW:338.269564151764
CID:673403
PubChem ID:71415639
Update Time:2025-04-19
2-Butenedioic acid, 2,3-dicyano-, bis[2-(acetyloxy)ethyl] ester, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenedioic acid, 2,3-dicyano-, bis[2-(acetyloxy)ethyl] ester, (2E)-
- bis(2-acetyloxyethyl) 2,3-dicyanobut-2-enedioate
- 833447-40-8
- Bis[2-(acetyloxy)ethyl] 2,3-dicyanobut-2-enedioate
- DTXSID40835050
-
- Inchi： 1S/C14H14N2O8/c1-9(17)21-3-5-23-13(19)11(7-15)12(8-16)14(20)24-6-4-22-10(2)18/h3-6H2,1-2H3
- InChI Key： SUPPFDPVCXNVTJ-UHFFFAOYSA-N
- SMILES： O(C(C(C#N)=C(C#N)C(=O)OCCOC(C)=O)=O)CCOC(C)=O
Computed Properties
- Exact Mass: 338.07501541g/mol
- Monoisotopic Mass: 338.07501541g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 24
- Rotatable Bond Count: 12
- Complexity: 590
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: -0.2
- Topological Polar Surface Area: 153?2
2-Butenedioic acid, 2,3-dicyano-, bis[2-(acetyloxy)ethyl] ester, (2E)- Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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3. 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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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