Cas no 29458-39-7 (6-Methoxy-3-methylpyrimidine-2,4(1H,3H)-dione)
29458-39-7 structure
Product Name:6-Methoxy-3-methylpyrimidine-2,4(1H,3H)-dione
CAS No:29458-39-7
MF:C6H8N2O3
MW:156.139321327209
CID:2839639
PubChem ID:13841873
Update Time:2025-04-21
6-Methoxy-3-methylpyrimidine-2,4(1H,3H)-dione Chemical and Physical Properties
Names and Identifiers
-
- 6-Methoxy-3-methylpyrimidine-2,4(1H,3H)-dione
- Z1509144316
- SCHEMBL17052945
- 29458-39-7
- SCHEMBL14339216
- DTXSID00551042
- G15807
- 6-METHOXY-3-METHYL-1,2,3,4-TETRAHYDROPYRIMIDINE-2,4-DIONE
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- Inchi: 1S/C6H8N2O3/c1-8-5(9)3-4(11-2)7-6(8)10/h3H,1-2H3,(H,7,10)
- InChI Key: CBEBWUBNSFGPOM-UHFFFAOYSA-N
- SMILES: O(C)C1=CC(N(C)C(N1)=O)=O
Computed Properties
- Exact Mass: 156.05349212g/mol
- Monoisotopic Mass: 156.05349212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 234
- 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: -0.6
- Topological Polar Surface Area: 58.6?2
6-Methoxy-3-methylpyrimidine-2,4(1H,3H)-dione Related Literature
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
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