6-bromo-2-[4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,2,4-triazine-3,5-dione
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6-bromo-2-[4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,2,4-triazine-3,5-dione
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CAS No:
29578-11-8
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Formula:
C9H12BrN3O6
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Chemical Name:
6-bromo-2-[4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,2,4-triazine-3,5-dione
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Synonyms:
29578-11-8;NSC130977;DTXSID50952060;NSC-130977;6-Bromo-2-(2-deoxyhexopyranosyl)-5-hydroxy-1,2,4-triazin-3(2H)-one
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CAS No:
6-bromo-2-[4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]-1,2,4-triazine-3,5-dione Basic Attributes
338.11 g/mol
336.99095 g/mol
130977
Computed Properties
Molecular Weight:338.11
XLogP3:-0.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:336.99095
Monoisotopic Mass:336.99095
Topological Polar Surface Area:132
Heavy Atom Count:19
Complexity:430
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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