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247167-54-0 | 2(5H)-Furanone, 4-bromo-5-(bromomethylene)-, (5Z)-
CAS No: 247167-54-0 Catalog No: AG002P6Y MDL No:
Product Description
Catalog Number:
AG002P6Y
Chemical Name:
2(5H)-Furanone, 4-bromo-5-(bromomethylene)-, (5Z)-
CAS Number:
247167-54-0
Molecular Formula:
C5H2Br2O2
Molecular Weight:
253.8762
IUPAC Name:
(5Z)-4-bromo-5-(bromomethylidene)furan-2-one
InChI:
InChI=1S/C5H2Br2O2/c6-2-4-3(7)1-5(8)9-4/h1-2H/b4-2-
InChI Key:
DPGLBHQUHFJRJS-RQOWECAXSA-N
SMILES:
Br/C=C/1\OC(=O)C=C1Br
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
253.84g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.877g/mol
Monoisotopic Mass:
251.842g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Structure-activity relationship of brominated 3-alkyl-5-methylene-2(5H)-furanones and alkylmaleic anhydrides as inhibitors of Salmonella biofilm formation and quorum sensing regulated bioluminescence in Vibrio harveyi. | Bioorganic & medicinal chemistry 20100715 |
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