Products for Research Use Only

Pigment Yellow 93

CAT: 0013-GTR19301236-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19301236-01Size:50 mg
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Description
Pigment Yellow 93 is a biologically active, solid-state fluorescent disazomethine compound. It is utilized in materials science research for its optical properties and serves as a tool in biochemical studies for both in vitro and cellular imaging applications.
CAS Number
5580-57-4
Molecular Weight
937.05
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

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)-
CAS Number5580-57-4
PubChem CID110674
IUPAC Name4-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
Molecular FormulaC43H35Cl5N8O6
Molecular Weight937.0
XLogP11.1
Topological Polar Surface Area200
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count14
Heavy Atom Count62
Formal Charge0
Complexity1680
SMILES
CC1=CC(=C(C=C1NC(=O)C(C(=O)C)N=NC2=C(C=CC(=C2)C(=O)NC3=C(C(=CC=C3)Cl)C)Cl)Cl)NC(=O)C(C(=O)C)N=NC4=C(C=CC(=C4)C(=O)NC5=C(C(=CC=C5)Cl)C)Cl
InChI
InChI=1S/C43H35Cl5N8O6/c1-20-16-35(52-43(62)39(24(5)58)56-54-37-18-26(13-15-30(37)47)41(60)50-33-11-7-9-28(45)22(33)3)31(48)19-34(20)51-42(61)38(23(4)57)55-53-36-17-25(12-14-29(36)46)40(59)49-32-10-6-8-27(44)21(32)2/h6-19,38-39H,1-5H3,(H,49,59)(H,50,60)(H,51,61)(H,52,62)
InChIKey
PFTIMORLWNOYIQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 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)-
CAS: 5580-57-4
CID: 110674
Formula: C43H35Cl5N8O6
MW: 937.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight937.0
XLogP311.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count10
Rotatable Bond Count14
Exact Mass936.109269
Monoisotopic Mass934.112219
Topological Polar Surface Area200 Ų
Heavy Atom Count62
Formal Charge0
Complexity1680
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes