Cas no 17331-66-7 (as-Triazine-3,5(2H,4H)-dione,2-(2-deoxy-b-D-arabino-hexopyranosyl)-6-methyl-(8CI))
17331-66-7 structure
Product Name:as-Triazine-3,5(2H,4H)-dione,2-(2-deoxy-b-D-arabino-hexopyranosyl)-6-methyl-(8CI)
CAS No:17331-66-7
MF:C10H15N3O6
MW:273.242602586746
CID:228177
PubChem ID:266321
Update Time:2025-04-19
as-Triazine-3,5(2H,4H)-dione,2-(2-deoxy-b-D-arabino-hexopyranosyl)-6-methyl-(8CI) Chemical and Physical Properties
Names and Identifiers
-
- as-Triazine-3,5(2H,4H)-dione,2-(2-deoxy-b-D-arabino-hexopyranosyl)-6-methyl-(8CI)
- 1-(4-Hydroxy-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-thiophen-2-yl-1H-pyrimidine-2,4-dione
- ACMC-20loq7
- AG-D-56869
- CHEBI:338473
- CTK4B5537
- Uridine, 2'-deoxy-5-(2-thienyl)-
- NSC103753
- 17331-66-7
- CHEMBL1885956
- ZINC01680550
- MLS002703785
- NSC-103753
- 2-(2-Deoxyhexopyranosyl)-5-hydroxy-6-methyl-1,2,4-triazin-3(2H)-one
- NCIOpen2_007250
- DTXSID00938354
- SMR001570500
-
- Inchi： 1S/C10H15N3O6/c1-4-9(17)11-10(18)13(12-4)7-2-5(15)8(16)6(3-14)19-7/h5-8,14-16H,2-3H2,1H3,(H,11,17,18)
- InChI Key： ZOKMYTQGKAOIFK-UHFFFAOYSA-N
- SMILES： O1C(CC(C(C1CO)O)O)N1C(NC(C(C)=N1)=O)=O
Computed Properties
- Exact Mass: 273.09615
- Monoisotopic Mass: 273.096
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 426
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 132A^2
- XLogP3: -1.9
Experimental Properties
- Density: 1.83
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.724
- PSA: 131.69
- LogP: -2.75840
as-Triazine-3,5(2H,4H)-dione,2-(2-deoxy-b-D-arabino-hexopyranosyl)-6-methyl-(8CI) Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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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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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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