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CHEBI:83658 - 5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione

ChEBI IDCHEBI:83658
ChEBI Name5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione
Stars
ASCII Name5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione
DefinitionA pyrimidone that is pyrimidine-2,4(1H,3H)-dione substituted by a bromo group at position 5, a butan-2-yl group at position 3 and a methyl group at position 6.
Last Modified10 November 2014
Submitternamrata
DownloadsMolfile
FormulaC9H13BrN2O2
Net Charge0
Average Mass261.119
Monoisotopic Mass260.01604
SMILESCCC(C)n1c(=O)nc(C)c(Br)c1=O
InChIInChI=1S/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14)
InChIKeyCTSLUCNDVMMDHG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione (CHEBI:83658) is a organobromine compound (CHEBI:37141)
5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione (CHEBI:83658) is a pyrimidone (CHEBI:38337)
Incoming Relation(s)
(R)-bromacil (CHEBI:83659) is a 5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione (CHEBI:83658)
(S)-bromacil (CHEBI:83660) is a 5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione (CHEBI:83658)
IUPAC Name 
5-bromo-3-(butan-2-yl)-6-methylpyrimidine-2,4(1H,3H)-dione
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