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Home Halogens 1H-Pyrazole-5-carboxamide, 4-chloro-3-ethyl-1-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]-

1H-Pyrazole-5-carboxamide, 4-chloro-3-ethyl-1-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]-

CAS No.:
129558-76-5
Catalog Number:
AG000Z80
Molecular Formula:
C21H22ClN3O2
Molecular Weight:
383.8713
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
>98%(HPLC)powder
In Stock USA
United States
$87
- +
25mg
>98%(HPLC)powder
In Stock USA
United States
$157
- +
100mg
>98%(HPLC)powder
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG000Z80
Chemical Name:
1H-Pyrazole-5-carboxamide, 4-chloro-3-ethyl-1-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]-
CAS Number:
129558-76-5
Molecular Formula:
C21H22ClN3O2
Molecular Weight:
383.8713
MDL Number:
MFCD08273850
IUPAC Name:
4-chloro-5-ethyl-2-methyl-N-[[4-(4-methylphenoxy)phenyl]methyl]pyrazole-3-carboxamide
InChI:
InChI=1S/C21H22ClN3O2/c1-4-18-19(22)20(25(3)24-18)21(26)23-13-15-7-11-17(12-8-15)27-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3,(H,23,26)
InChI Key:
WPALTCMYPARVNV-UHFFFAOYSA-N
SMILES:
CCc1nn(c(c1Cl)C(=O)NCc1ccc(cc1)Oc1ccc(cc1)C)C
UNII:
OHA74571QT
Properties
Complexity:
476  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.14g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
383.876g/mol
Monoisotopic Mass:
383.14g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Literature
Title Journal
Evidence of the in vitro genotoxicity of methyl-pyrazole pesticides in human cells. Mutation research 20121009
Analysis of tolfenpyrad and its metabolites in plasma in a tolfenpyrad poisoning case. Journal of analytical toxicology 20120901
Characterization of Paecilomycescinnamomeus from the camellia whitefly, Aleurocanthus camelliae (Hemiptera: Aleyrodidae), infesting tea in Japan. Journal of invertebrate pathology 20120501
Risk assessment of selected insecticides on Tamarixia triozae (Hymenoptera: Eulophidae), a parasitoid of Bactericera cockerelli (Hemiptera: Trizoidae). Journal of economic entomology 20120401
Design, synthesis, and insecticidal activity of novel pyrazole derivatives containing α-hydroxymethyl-N-benzyl carboxamide, α-chloromethyl-N-benzyl carboxamide, and 4,5-dihydrooxazole moieties. Journal of agricultural and food chemistry 20120215
[Acute tebufenpyrad and tolfenpyrad poisoning in humans]. Chudoku kenkyu : Chudoku Kenkyukai jun kikanshi = The Japanese journal of toxicology 20101201
Properties