Cas no 202350-72-9 (2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, methyl ester (9CI))
202350-72-9 structure
Product Name:2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, methyl ester (9CI)
CAS No:202350-72-9
MF:C8H10N2O4
MW:198.176002025604
CID:909356
PubChem ID:15866417
Update Time:2025-04-19
2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, methyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, methyl ester (9CI)
- methyl 4,6-dimethoxypyrimidine-2-carboxylate
- DTXSID501195479
- SCHEMBL8404026
- 202350-72-9
- methyl4,6-dimethoxypyrimidine-2-carboxylate
- 2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, methyl ester
-
- Inchi: 1S/C8H10N2O4/c1-12-5-4-6(13-2)10-7(9-5)8(11)14-3/h4H,1-3H3
- InChI Key: XLPFNDOHVMQGAD-UHFFFAOYSA-N
- SMILES: O(C)C1C=C(N=C(C(=O)OC)N=1)OC
Computed Properties
- Exact Mass: 198.06405680g/mol
- Monoisotopic Mass: 198.06405680g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 188
- 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
- Topological Polar Surface Area: 70.5?2
2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, methyl ester (9CI) Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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