[(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] thiocyanate
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[(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] thiocyanate
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CAS No:
108895-44-9
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Formula:
C11H13N3O4S
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Chemical Name:
[(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] thiocyanate
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Synonyms:
3'-SCN-ddT;Thymidine, 3'-thio-, 3'-cyanate;3'-Thiocyanato-2',3'-dideoxythymidine;108895-44-9;3'-S-Cyano-3'-thiothymidine;CHEMBL430340;3'-thiocyano-3'-deoxythymidine;DTXSID70148761;[(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] thiocyanate;[(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl] thiocyanate
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CAS No:
[(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] thiocyanate Basic Attributes
283.31 g/mol
283.06267708 g/mol
DTXSID70148761
Computed Properties
Molecular Weight:283.31
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:283.06267708
Monoisotopic Mass:283.06267708
Topological Polar Surface Area:128
Heavy Atom Count:19
Complexity:484
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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