Anisidine blue structure

Anisidine blue

tetrasodium;2-[4-[4-[bis(carboxylatomethyl)amino]-3-methoxyphenyl]-N-(carboxylatomethyl)-2-methoxyanilino]acetate

Also Known As: Anisidine blue|EINECS 262-379-0|Tetrasodium N,N'-(3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(N-(carboxylatomethyl)aminoacetate)|tetrasodium 2,2',2'',2'''-[(3,3'-dimethoxybiphenyl-4,4'-diyl)dinitrilo]tetraacetate|Tetrasodium N,N'-(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis[N-(carboxylatomethyl)aminoacetate]|Tetrasodium nn'-(3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(N-(carboxylatomethyl)aminoacetate)|262-379-0|Tetrasodium 2,2',2'',2'''-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)dinitrilo]tetraacetate|tetrasodium 2-[4-[4-[bis(2-oxido-2-oxoethyl)amino]-3-methoxyphenyl]-2-methoxy-N-(2-oxido-2-oxoethyl)anilino]acetate|Tetrasodium N,N-(3,3-dimethoxy(1,1-biphenyl)-4,4-diyl)bis(N-(carboxylatomethyl)aminoacetate)|tetrasodium,2-[4-[4-[bis(carboxylatomethyl)amino]-3-methoxyphenyl]-N-(carboxylatomethyl)-2-methoxyanilino]acetate

CAS: 60683-89-8
Molecular Formula C22H20N2Na4O10
Molecular Weight 564.07086 g/mol
LogP -16.0
Topological Polar Surface Area 185.46 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 12
Rotatable Bonds 13
Exact Mass 564.07086
Heavy Atoms 38
Complexity 986.3

Chemical Identifiers

CAS Number 60683-89-8
SMILES COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N(CC(=O)[O-])CC(=O)[O-])OC)N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Product Overview

Anisidine blue (CAS 60683-89-8), with molecular formula C22H20N2Na4O10 and molecular weight 564.07086 g/mol. IUPAC: tetrasodium;2-[4-[4-[bis(carboxylatomethyl)amino]-3-methoxyphenyl]-N-(carboxylatomethyl)-2-methoxyanilino]acetate.

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