4-(5-bromo-2-thienyl)-3-chloro-4-oxo-butanoic acid

ChemSpider ID: 25699944
Molecular Formula: C₈H₆BrClO₃S
Average mass: 297.553009 Da
Monoisotopic mass: 295.891 Da
Systematic name

4-(5-bromo-2-thienyl)-3-chloro-4-oxo-butanoic acid
SMILES and InChIs

SMILES:

c1cc(sc1C(=O)C(CC(=O)O)Cl)Br Copied

Std. InChI:

InChI=1S/C8H6BrClO3S/c9-6-2-1-5(14-6)8(13)4(10)3-7(11)12/h1-2,4H,3H2,(H,11,12) Copied

Std. InChIKey:

CSPJGSDYBCUJSI-UHFFFAOYSA-N Copied
Cite this record
CSID:25699944, http://www.chemspider.com/Chemical-Structure.25699944.html (accessed 12:19, May 25, 2012) Copied

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Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

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