Cas no 1508-11-8 (Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester)
![Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester structure](https://ossimg.kuujia.com/scimg/2000/1508-11-8x500.png)
1508-11-8 structure
Product Name:Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester
CAS No:1508-11-8
MF:C12H19NO4
MW:241.28356385231
CID:232504
PubChem ID:5358556
Update Time:2025-04-19
Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester
- diethyl 2-[(E)-3-(dimethylamino)prop-2-enylidene]propanedioate
- 2-[(E)-3-dimethylamino-prop-2-enylidene]-propanedioic acid diethyl ester
- 4-Dimethylamino-buta-1,3-dien-1,1-dicarbonsaeure-diaethylester
- AC1NSCQL
- NSC263805
- Diethyl [(2E)-3-(dimethylamino)prop-2-en-1-ylidene]propanedioate
- SCHEMBL14279175
- 1508-11-8
- DTXSID90418418
- NSC-263805
-
- Inchi： 1S/C12H19NO4/c1-5-16-11(14)10(12(15)17-6-2)8-7-9-13(3)4/h7-9H,5-6H2,1-4H3/b9-7+
- InChI Key： OCXNVSPPCFBPSP-VQHVLOKHSA-N
- SMILES： O(CC)C(/C(/C(=O)OCC)=C/C=C/N(C)C)=O
Computed Properties
- Exact Mass: 241.13147
- Monoisotopic Mass: 241.131
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 299
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 55.8A^2
- XLogP3: 1.9
Experimental Properties
- Density: 1.058
- Boiling Point: 289.3°Cat760mmHg
- Flash Point: 128.7°C
- Refractive Index: 1.481
- PSA: 55.84
- LogP: 1.11430
Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
1508-11-8 (Propanedioic acid,2-[3-(dimethylamino)-2-propen-1-ylidene]-, 1,3-diethyl ester) Related Products
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