CHEBI:52158 - monochlorobimane

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ChEBI Name monochlorobimane
ChEBI ID CHEBI:52158
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C10H11ClN2O2
Net Charge 0
Average Mass 226.66000
Monoisotopic Mass 226.05091
InChI InChI=1S/C10H11ClN2O2/c1-5-7(3)12-8(4-11)6(2)10(15)13(12)9(5)14/h4H2,1-3H3
InChIKey SUIPVTCEECPFIB-UHFFFAOYSA-N
SMILES Cc1c(C)c(=O)n2n1c(CCl)c(C)c2=O
Roles Classification
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
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ChEBI Ontology
Outgoing monochlorobimane (CHEBI:52158) has role fluorochrome (CHEBI:51217)
monochlorobimane (CHEBI:52158) is a organochlorine compound (CHEBI:36683)
monochlorobimane (CHEBI:52158) is a pyrazolopyrazole (CHEBI:62826)
IUPAC Name
3-(chloromethyl)-2,5,6-trimethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione
Synonym Source
NSC602733 ChEBI
Registry Numbers Types Sources
4440901 Beilstein Registry Number Beilstein
76421-73-3 CAS Registry Number ChemIDplus
Last Modified
16 October 2014