Cas no 131194-00-8 (2,4(1H,3H)-Pyrimidinedione,1-[(2-hydroxyethoxy)methyl]-6-methoxy-5-methyl-)
131194-00-8 structure
Product Name:2,4(1H,3H)-Pyrimidinedione,1-[(2-hydroxyethoxy)methyl]-6-methoxy-5-methyl-
CAS No:131194-00-8
MF:C9H14N2O5
MW:230.217862606049
CID:180377
PubChem ID:452901
Update Time:2025-04-19
2,4(1H,3H)-Pyrimidinedione,1-[(2-hydroxyethoxy)methyl]-6-methoxy-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4(1H,3H)-Pyrimidinedione,1-[(2-hydroxyethoxy)methyl]-6-methoxy-5-methyl-
- 1-(2-hydroxyethoxymethyl)-6-methoxy-5-methylpyrimidine-2,4-dione
- 1-((2-Hydroxyethoxy)methyl)-6-methoxythymine
- 1-[(2-Hydroxyethoxy)methyl]-6-methoxythymine
- 2,4(1H,3H)-Pyrimidinedione, 1-((2-hydroxyethoxy)methyl)-6-methoxy-5-methyl-
- CHEMBL331555
- 2,4(1H,3H)-Pyrimidinedione, 1-[(2-hydroxyethoxy)methyl]-6-methoxy-5-methyl-
- 131194-00-8
- 1-(2OHEtOMe)-6MeOT
- DTXSID30156943
- 1-(2-hydroxyethoxymethyl)-6-methoxy-5-methyl-pyrimidine-2,4-dione
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- Inchi: 1S/C9H14N2O5/c1-6-7(13)10-9(14)11(8(6)15-2)5-16-4-3-12/h12H,3-5H2,1-2H3,(H,10,13,14)
- InChI Key: ZGCYJTDWRJBEGZ-UHFFFAOYSA-N
- SMILES: O(CCO)CN1C(NC(C(C)=C1OC)=O)=O
Computed Properties
- Exact Mass: 230.09032
- Monoisotopic Mass: 230.09027155g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 326
- 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: 88.1?2
Experimental Properties
- PSA: 88.1
2,4(1H,3H)-Pyrimidinedione,1-[(2-hydroxyethoxy)methyl]-6-methoxy-5-methyl- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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