Benzenesulfonic acid, 2,2'-[(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)diimino]bis[5-methyl-

5-methyl-2-[[4-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid

CAS: 3443-90-1

Molecular Formula	`C28H22N2O8S2`
Molecular Weight	578.6 g/mol
LogP	5.3
Topological Polar Surface Area	184.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	10
Rotatable Bonds	6
Exact Mass	578.0818
Heavy Atoms	40
Complexity	1090.0

Chemical Identifiers

CAS Number	3443-90-1
SMILES	`CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C)S(=O)(=O)O)C(=O)C5=CC=CC=C5C3=O)S(=O)(=O)O`
InChIKey	`BGBDMEPBLWJCHI-UHFFFAOYSA-N`

📖 Product Overview

Benzenesulfonic acid, 2,2'-[(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)diimino]bis[5-methyl- (CAS: 3443-90-1) is a chemical compound with molecular formula C28H22N2O8S2 and molecular weight 578.6 g/mol. Its IUPAC systematic name is 5-methyl-2-[[4-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid. LogP 5.3 Topological Polar Surface Area 184.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 10 Rotatable Bonds 6 Exact Mass 578.0818 Heavy Atoms 40 Complexity 1090.0 InChI Key: BGBDMEPBLWJCHI-UHFFFAOYSA-N. SMILES: CC1=CC(=C(C=C1)NC2=C3C(=C(C=C2)NC4=C(C=C(C=C4)C)S(=O)(=O)O)C(=O)C5=CC=CC=C5C3=O)S(=O)(=O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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