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C.I. Acid brown 75

CAT: 0013-GTR19345723-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19345723-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
C.I. Acid Brown 75 is an acidic dye effectively removed via adsorption onto bentone clay. This property makes it useful in environmental research for studying wastewater treatment processes, particularly in laboratory-scale experiments modeling the decolorization of industrial effluents.
CAS Number
6637-87-2
Field of Research
Metabolism Research
Molecular Weight
843.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Disodium 4-((2,4-dihydroxy-5-((2-hydroxy-3,5-dinitrophenyl)azo)-3-((4-nitrophenyl)azo)phenyl)azo)-5-hydroxynaphthalene-2,7-disulphonate

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CAS Number6637-87-2
PubChem CID16131135
IUPAC Namedisodium;4-[[2,4-dihydroxy-5-[(2-hydroxy-3,5-dinitrophenyl)diazenyl]-3-[(4-nitrophenyl)diazenyl]phenyl]diazenyl]-5-hydroxynaphthalene-2,7-disulfonate
Molecular FormulaC28H15N9Na2O16S2
Molecular Weight843.6
Topological Polar Surface Area424
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count22
Rotatable Bond Count6
Heavy Atom Count57
Formal Charge0
Complexity1690
SMILES
C1=CC(=CC=C1N=NC2=C(C(=CC(=C2O)N=NC3=C4C(=CC(=C3)S(=O)(=O)[O-])C=C(C=C4O)S(=O)(=O)[O-])N=NC5=C(C(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-])O)O)[N+](=O)[O-].[Na+].[Na+]
InChI
InChI=1S/C28H17N9O16S2.2Na/c38-23-10-17(55(51,52)53)6-12-5-16(54(48,49)50)9-18(24(12)23)30-32-20-11-21(33-31-19-7-15(36(44)45)8-22(26(19)39)37(46)47)28(41)25(27(20)40)34-29-13-1-3-14(4-2-13)35(42)43;;/h1-11,38-41H,(H,48,49,50)(H,51,52,53);;/q;2*+1/p-2
InChIKey
SKCQDFLBBMGDPT-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Disodium 4-((2,4-dihydroxy-5-((2-hydroxy-3,5-dinitrophenyl)azo)-3-((4-nitrophenyl)azo)phenyl)azo)-5-hydroxynaphthalene-2,7-disulphonate
CAS: 6637-87-2
CID: 16131135
Formula: C28H15N9Na2O16S2
MW: 843.6
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight843.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count22
Rotatable Bond Count6
Exact Mass842.98735634
Monoisotopic Mass842.98735634
Topological Polar Surface Area424 Ų
Heavy Atom Count57
Formal Charge0
Complexity1690
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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