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28279-36-9

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Basic Information
CAS No.: 28279-36-9
Name: 3-[[2-[2,4-Bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-[4,5-dihydro-4-(4-methoxyphenyl)diazenyl-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide
Molecular Structure:
Molecular Structure of 28279-36-9 (3-[[2-[2,4-Bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-[4,5-dihydro-4-(4-methoxyphenyl)diazenyl-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide)
Formula: C41H43Cl3N6O5
Molecular Weight: 806.18
Synonyms: Acetanilide,2-(2,4-di-tert-pentylphenoxy)-3'-[[4-[(p-methoxyphenyl)azo]-5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]carbamoyl]-(8CI);Benzamide,3-[[[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-4-[(4-methoxyphenyl)azo]-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-(9CI);1-(2,4,6-Trichlorophenyl)-3-[3-(a-2,4-di-tert-amylphenoxy)acetamido]benzamido-4-(4'-methoxyphenylazo)-5-pyrazolone;1-(2,4,6-Trichlorophenyl)-3-[3-[a-(2,4-di-tert-amylphenoxy)acetamido]benzamido]-4-(4-methoxyphenylazo)-5-pyrazolone;1-(2,4,6-Trichlorophenyl)-3-[3'-(2,4-di-tert-amylphenoxyacetamido)benzamido]-4-(4-methoxyphenylazo)-5-pyrazolone;1-(2,4,6-Trichlorophenyl)-3-[[3'-(2,4-di-tert-amylphenoxy)acetamido]benzamido]-4-(p-methoxyphenylazo)-5-pyrazolone;
EINECS: 248-935-5
Density: 1.3g/cm3
Melting Point: 158-163 °C
PSA: 134.05000
LogP: 10.25520
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Chemistry

IUPAC Name: 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-[4-(4-methoxyphenyl)diazenyl-5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide 
Empirical Formula: C41H43Cl3N6O5
Molecular Weight: 806.17632
EINECS: 248-935-5 
Structure of Benzamide,3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-4-[2-(4-methoxyphenyl)diazenyl]-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]- (CAS NO.28279-36-9):

Product Categories: Organics 
Canonical SMILES: CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=CC(=C2)C(=O)NC3=NN(C(=O)C3N=NC4=CC=C(C=C4)OC)C5=C(C=C(C=C5Cl)Cl)Cl)C(C)(C)CC
InChI: InChI=1S/C41H43Cl3N6O5/c1-8-40(3,4)25-13-18-33(30(20-25)41(5,6)9-2)55-23-34(51)45-28-12-10-11-2(19-28)38(52)46-37-35(48-47-27-14-16-29(54-7)17-15-27)39(53)50(49-37)36-31(43)21-26(42)22-32(36)44/h10-22,35H,8-9,23H2,1-7H3,(H,45,51)(H,46,49,52)
InChIKey: GKFRFXGNFWGAEB-UHFFFAOYSA-N

Specification

 Benzamide,3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-4-[2-(4-methoxyphenyl)diazenyl]-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]- , its cas register number is 28279-36-9. It also can be called 4-(((2,4-Bis(tert-pentyl)phenoxy)acetyl)amino)-N-(4,5-dihydro-5-((4-methoxyphenyl)azo)-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl)benzamide ; Acetanilide,2-(2,4-di-tert-pentylphenoxy)-3'-[[4-[(p-methoxyphenyl)azo]-5-oxo-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]carbamoyl]-(8CI) ; 1-(2,4,6-Trichlorophenyl)-3-[3-(a-2,4-di-tert-amylphenoxy)acetamido]benzamido-4-(4'-methoxyphenylazo)-5-pyrazolone .