3-[[4-[[4-(4-ethoxyanilino)phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate,hydron

Modify Date: 2025-09-24 23:02:18

3-[[4-[[4-(4-ethoxyanilino)phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate,hydron Structure
3-[[4-[[4-(4-ethoxyanilino)phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate,hydron structure
Common Name 3-[[4-[[4-(4-ethoxyanilino)phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate,hydron
CAS Number 25305-85-5 Molecular Weight 803.98500
Density N/A Boiling Point N/A
Molecular Formula C45H45N3O7S2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-[[4-[[4-(4-ethoxyanilino)phenyl]-[4-[ethyl-[(3-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate,hydron
Synonym More Synonyms

 Chemical & Physical Properties

Molecular Formula C45H45N3O7S2
Molecular Weight 803.98500
Exact Mass 803.27000
PSA 155.84000
LogP 10.84230
InChIKey PLVPREXUKUFADG-UHFFFAOYSA-N
SMILES CCOc1ccc(Nc2ccc(C(=C3C=CC(=[N+](CC)Cc4cccc(S(=O)(=O)[O-])c4)C=C3)c3ccc(N(CC)Cc4cccc(S(=O)(=O)[O-])c4)cc3)cc2)cc1.[H+]

 Synonyms

EINECS 246-800-5
hydrogen [4-({4-[(4-ethoxyphenyl)amino]phenyl}{4-[ethyl(3-sulfonatobenzyl)amino]phenyl}methylene)cyclohexa-2,5-dien-1-ylidene](ethyl)(3-sulfonatobenzyl)ammonium
Hydrogen (4-((4-((4-ethoxyphenyl)amino)phenyl)(4-(ethyl(3-sulphonatobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)(3-sulphonatobenzyl)ammonium
Coomassie Brilliant Blue R
CI Acid Blue 83 (Coomassie Brillian Blue R)-Saeure
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