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CHEBI:62825 - monobromobimane

Default Structure
ChEBI IDCHEBI:62825
ChEBI Namemonobromobimane
Stars
DefinitionA pyrazolopyrazole that consists of 1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione bearing three methyl substituents at positions 2, 5 and 6 as well as a bromomethyl substituent at the 3-position.
Last Modified31 August 2011
SubmitterSteve
DownloadsMolfile
FormulaC10H11BrN2O2
Net Charge0
Average Mass271.114
Monoisotopic Mass270.00039
SMILESCc1c(C)n2c(CBr)c(C)c(=O)n2c1=O
InChIInChI=1S/C10H11BrN2O2/c1-5-7(3)12-8(4-11)6(2)10(15)13(12)9(5)14/h4H2,1-3H3
InChIKeyAHEWZZJEDQVLOP-UHFFFAOYSA-N
Wikipedia
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
monobromobimane (CHEBI:62825) has role fluorochrome (CHEBI:51217)
monobromobimane (CHEBI:62825) is a organobromine compound (CHEBI:37141)
monobromobimane (CHEBI:62825) is a pyrazolopyrazole (CHEBI:62826)
IUPAC Name 
3-(bromomethyl)-2,5,6-trimethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione
Synonyms  Source
Bimane monobromideChEBI
BromobimaneChemIDplus
MBBRChemIDplus
Manual XrefsDatabases
BromobimaneWikipedia
CPD1G-159MetaCyc
Registry NumbersSources
Reaxys:4186557Reaxys
CAS:71418-44-5ChemIDplus
Citations