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Home Halogens 2-Furancarboxylic acid, 1-(2,2-dichloroacetyl)-1,2,3,4-tetrahydro-6-quinolinyl ester

2-Furancarboxylic acid, 1-(2,2-dichloroacetyl)-1,2,3,4-tetrahydro-6-quinolinyl ester

CAS No.:
62265-68-3
Catalog Number:
AG0035K5
Molecular Formula:
C16H13Cl2NO4
Molecular Weight:
354.1847
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Product Description
Catalog Number:
AG0035K5
Chemical Name:
2-Furancarboxylic acid, 1-(2,2-dichloroacetyl)-1,2,3,4-tetrahydro-6-quinolinyl ester
CAS Number:
62265-68-3
Molecular Formula:
C16H13Cl2NO4
Molecular Weight:
354.1847
MDL Number:
MFCD00864662
IUPAC Name:
[1-(2,2-dichloroacetyl)-3,4-dihydro-2H-quinolin-6-yl] furan-2-carboxylate
InChI:
InChI=1S/C16H13Cl2NO4/c17-14(18)15(20)19-7-1-3-10-9-11(5-6-12(10)19)23-16(21)13-4-2-8-22-13/h2,4-6,8-9,14H,1,3,7H2
InChI Key:
SBJGFIXQRZOVTO-UHFFFAOYSA-N
SMILES:
O=C(N1CCCc2c1ccc(c2)OC(=O)c1ccco1)C(Cl)Cl
EC Number:
263-478-1
UNII:
O1ZB1046R1
Properties
Complexity:
459  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.022g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.183g/mol
Monoisotopic Mass:
353.022g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Nitazoxanide compared with quinfamide and mebendazole in the treatment of helminthic infections and intestinal protozoa in children. The American journal of tropical medicine and hygiene 20020301
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