Cas no 91743-83-8 (Diethyl 3,9-dioxoundecanedioate)
91743-83-8 structure
Product Name:Diethyl 3,9-dioxoundecanedioate
CAS No:91743-83-8
MF:C15H24O6
MW:300.347465515137
CID:2845282
PubChem ID:71328459
Update Time:2025-04-21
Diethyl 3,9-dioxoundecanedioate Chemical and Physical Properties
Names and Identifiers
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- DTXSID90757410
- Diethyl 3,9-dioxoundecanedioate
- 91743-83-8
-
- Inchi： 1S/C15H24O6/c1-3-20-14(18)10-12(16)8-6-5-7-9-13(17)11-15(19)21-4-2/h3-11H2,1-2H3
- InChI Key： URRSDGPHLLCILE-UHFFFAOYSA-N
- SMILES： O=C(CC(=O)OCC)CCCCCC(CC(=O)OCC)=O
Computed Properties
- Exact Mass: 300.15728848Da
- Monoisotopic Mass: 300.15728848Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 14
- Complexity: 327
- 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: 86.7?2
Diethyl 3,9-dioxoundecanedioate Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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