Pigment Yellow 93 supplier | CasNO.5580-57-4

Name
3,3'-[(2-chloro-5-methyl-p-phenylene)bis[imino(1-acetyl-2-oxoethylene)azo]]bis[4-chloro-N-(3-chloro-o-tolyl)benzamide]
EINECS 226-970-7
CAS No. 5580-57-4
Density 1.45g/cm³
Solubility
Melting Point
Formula C₄₃H₃₅Cl₅N₈O₆
Boiling Point 905.9°C at 760mmHg
Molecular Weight 937.053
Flash Point 501.7°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzamide,3,3'-[(2-chloro-5-methyl-1,4-phenylene)bis[imino(1-acetyl-2-oxo-2,1-ethanediyl)azo]]bis[4-chloro-N-(3-chloro-2-methylphenyl)-(9CI);o-Benzotoluidide,3,3''-[(2-chloro-5-methyl-p-phenylene)bis(iminocarbonylacetonylideneazo)]bis[3',4-dichloro-(8CI);C.I. 20710;C.I. Pigment Yellow 93;Chromofine Yellow 5930;CromophtalYellow 3G;Microlith Yellow 3G-K;Microlith Yellow 3GT;Microlith Yellow 4G-A;PY 93;Pigment Yellow 93;Yellow 3GT;
PSA 199.98000
LogP 12.03540

Pigment Yellow 93 Specification

The cas register number of Pigment Yellow 93 is 5580-57-4. It also can be called as Benzamide, 3,3'-((2-chloro-5-methyl-1,4-phenylene)bis(imino(1-acetyl-2-oxo-2,1-ethanediyl)-2,1-diazenediyl))bis(4-chloro-N-(3-chloro-2-methylphenyl)- and the Systematic name about this chemical is 4-chloro-3-[[1-[5-chloro-4-[[2-[[2-chloro-5-[(3-chloro-2-methylphenyl)carbamoyl]phenyl]diazenyl]-3-oxobutanoyl]amino]-2-methylanilino]-1,3-dioxobutan-2-yl]diazenyl]-N-(3-chloro-2-methylphenyl)benzamide.

Physical properties about Pigment Yellow 93 are: (1)ACD/LogP: 11.27; (2)# of Rule of 5 Violations: 3; (3)ACD/LogD (pH 5.5): 11.26; (4)ACD/LogD (pH 7.4): 10.94; (5)#H bond acceptors: 14; (6)#H bond donors: 4; (7)#Freely Rotating Bonds: 16; (8)Polar Surface Area: 199.98Å²; (9)Index of Refraction: 1.667; (10)Molar Refractivity: 239.6 cm³; (11)Molar Volume: 643.1 cm³; (12)Surface Tension: 53.5 dyne/cm; (13)Density: 1.45 g/cm³.

People can use the following data to convert to the molecule structure.
1.SMILES: Clc4ccc(cc4N=NC(=O)C(Nc3cc(C)c(NC(C(C)=O)C(=O)N=Nc1cc(ccc1Cl)C(=O)Nc2cccc(Cl)c2C)cc3Cl)C(C)=O)C(=O)Nc5cccc(Cl)c5C
2.InChI: InChI=1/C43H35Cl5N8O6/c1-20-16-35(50-39(24(5)58)43(62)56-54-37-18-26(13-15-30(37)47)41(60)52-33-11-7-9-28(45)22(33)3)31(48)19-34(20)49-38(23(4)57)42(61)55-53-36-17-25(12-14-29(36)46)40(59)51-32-10-6-8-27(44)21(32)2/h6-19,38-39,49-50H,1-5H3,(H,51,59)(H,52,60)
3.InChIKey: KAVHKVKDGSYKEL-UHFFFAOYAE
4.Std. InChI: InChI=1S/C43H35Cl5N8O6/c1-20-16-35(50-39(24(5)58)43(62)56-54-37-18-26(13-15-30(37)47)41(60)52-33-11-7-9-28(45)22(33)3)31(48)19-34(20)49-38(23(4)57)42(61)55-53-36-17-25(12-14-29(36)46)40(59)51-32-10-6-8-27(44)21(32)2/h6-19,38-39,49-50H,1-5H3,(H,51,59)(H,52,60)

Product Name

3,3'-[(2-chloro-5-methyl-p-phenylene)bis[imino(1-acetyl-2-oxoethylene)azo]]bis[4-chloro-N-(3-chloro-o-tolyl)benzamide]

Pigment Yellow 93 Specification

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