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Home Halogens 4-Pyridazinecarboxylic acid, 2-(4-chlorophenyl)-3-ethyl-2,5-dihydro-5-oxo-

4-Pyridazinecarboxylic acid, 2-(4-chlorophenyl)-3-ethyl-2,5-dihydro-5-oxo-

CAS No.:
129025-54-3
Catalog Number:
AG000YSW
Molecular Formula:
C13H11ClN2O3
Molecular Weight:
278.6910
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Product Description
Catalog Number:
AG000YSW
Chemical Name:
4-Pyridazinecarboxylic acid, 2-(4-chlorophenyl)-3-ethyl-2,5-dihydro-5-oxo-
CAS Number:
129025-54-3
Molecular Formula:
C13H11ClN2O3
Molecular Weight:
278.6910
MDL Number:
MFCD28047773
IUPAC Name:
2-(4-chlorophenyl)-3-ethyl-5-oxopyridazine-4-carboxylic acid
InChI:
InChI=1S/C13H11ClN2O3/c1-2-10-12(13(18)19)11(17)7-15-16(10)9-5-3-8(14)4-6-9/h3-7H,2H2,1H3,(H,18,19)
InChI Key:
PIZCXVUFSNPNON-UHFFFAOYSA-N
SMILES:
CCc1c(C(=O)O)c(=O)cnn1c1ccc(cc1)Cl
EC Number:
603-312-0
UNII:
Q4N3YI429F
Properties
Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.046g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
278.692g/mol
Monoisotopic Mass:
278.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
70A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
[Analytical method of clofencet in animal fishery products by LC/MS]. Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan 20110101
Sorption of weak organic acids in soils: clofencet, 2,4-D and salicylic acid. Chemosphere 20011101
Properties