B2KF5RS9U3 structure

B2KF5RS9U3

5-[(2,4-dimethoxybenzoyl)amino]-2-[(E)-2-[4-[(2,4-dimethoxybenzoyl)amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid

Also Known As: 2,2'-Stilbenedisulfonic acid, 4,4'-bis(2,4-dimethoxybenzamido)-|4,4''-Bis(2,4-dimethoxybenzamido)-2,2''-stilbenedisulfonic acid|5-[(2,4-dimethoxybenzoyl)amino]-2-[(E)-2-[4-[(2,4-dimethoxybenzoyl)amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid

CAS: 25807-07-2
Molecular Formula C32H30N2O12S2
Molecular Weight 698.124 g/mol
LogP 4.8894
Topological Polar Surface Area 203.86 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 10
Rotatable Bonds 12
Exact Mass 698.124
Monoisotopic Mass 698.124
Heavy Atoms 48
Complexity 1977.9293

Chemical Identifiers

CAS Number 25807-07-2
SMILES COC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC(=O)C4=C(C=C(C=C4)OC)OC)S(=O)(=O)O)S(=O)(=O)O)OC

Product Overview

B2KF5RS9U3 (CAS 25807-07-2), with molecular formula C32H30N2O12S2 and molecular weight 698.124 g/mol. IUPAC: 5-[(2,4-dimethoxybenzoyl)amino]-2-[(E)-2-[4-[(2,4-dimethoxybenzoyl)amino]-2-sulfophenyl]ethenyl]benzenesulfonic acid.

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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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