Cas no 188936-17-6 (5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-4-propyl-, ethyl ester)
188936-17-6 structure
Product Name:5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-4-propyl-, ethyl ester
CAS No:188936-17-6
MF:C10H14N2O3
MW:210.229762554169
CID:3843811
PubChem ID:10703645
Update Time:2025-04-22
5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-4-propyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-4-propyl-, ethyl ester
- 5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-6-propyl-, ethyl ester
- DB-115968
- 188936-17-6
- SCHEMBL8395135
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- Inchi： 1S/C10H14N2O3/c1-3-5-8-7(9(13)15-4-2)6-11-10(14)12-8/h6H,3-5H2,1-2H3,(H,11,12,14)
- InChI Key： CPUUXQXDKMTFPW-UHFFFAOYSA-N
- SMILES： C1(=O)NC(CCC)=C(C(OCC)=O)C=N1
Computed Properties
- Exact Mass: 210.10044231Da
- Monoisotopic Mass: 210.10044231Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 332
- 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: 0.9
- Topological Polar Surface Area: 67.8?2
5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-4-propyl-, ethyl ester Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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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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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
188936-17-6 (5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-4-propyl-, ethyl ester) Related Products
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