2,3,4,5-Tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid

Base Information

Chemical Name:2,3,4,5-Tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid
CAS No.:152-74-9
Molecular Formula:C20H4Cl4I4O5
Molecular Weight:973.679
Hs Code.:
European Community (EC) Number:601-063-2
DSSTox Substance ID:DTXSID20859517
Nikkaji Number:J84.910C
Wikidata:Q27088610
Metabolomics Workbench ID:67047
ChEMBL ID:CHEMBL1208422
Mol file:152-74-9.mol

Synonyms:rose-bengal;CHEBI:87202;Acid Red 94;2,3,4,5-tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid;152-74-9;11121-48-5;2,3,4,5-Tetrachloro-6-(6-hydroxy-2,4,5,7-tetraiodo-3-oxo-3H-xanthen-9-yl)benzoic acid;NSC10463;NSC45732;NSC-10463;NSC270091;C.I.45440;C.I. 45440;Bengalrosa;rose bengal free acid;Ak-Rose Liq 1%;D07LZY;Tetraiodotetrachlorofluorescein;GTPL2393;SCHEMBL1464825;CHEMBL1208422;DTXSID20859517;BDBM50541116;NSC819979;DB11182;NSC-819979;2,3,4,5-tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxoxanthen-9-yl)benzoic acid;LS-194354;EN300-30839364;SR-01000939637;SR-01000939637-2;Q27088610;2',4',5',7'-tetrabromo-2,3,4,5-tetraiodofluorescein;3,4,5,6-Tetrachloro-2',4',5',7'-tetraiodofluorescein, 8CI;4,5,6,7-Tetrachloro-3',6'-dihydroxy-2',4',5',7'-tetraiodospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one, 9CI;4,5,6,7-Tetrachloro-3'-6'-dihydroxy-2',4',5',7'-tetraiosospiro[isobenzofuran-1(3H),9'-[9H]xanthen[-3-one

Suppliers and Price of 2,3,4,5-Tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of 2,3,4,5-Tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid

Chemical Property:

Boiling Point:741.8°Cat760mmHg
Flash Point:402.4°C
Density:2.96g/cm³
XLogP3:7.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:973.4962
Heavy Atom Count:33
Complexity:988

Purity/Quality:: 97% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=C2C(=C3C=C(C(=O)C(=C3OC2=C(C(=C1I)O)I)I)I)C4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)C(=O)O

Technology Process of 2,3,4,5-Tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid

There total 1 articles about 2,3,4,5-Tetrachloro-6-(3-hydroxy-2,4,5,7-tetraiodo-6-oxo-xanthen-9-yl)benzoic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 43.0%

: 13245-63-1
3',4',5',6'-tetrachlorofluorescein

: 152-74-9
Rose-Bengale

Guidance literature:: With iodine; iodic acid; In ethanol; water; at 60 ℃;
DOI:10.1016/j.bmc.2010.06.069

Reference yield: 42.0%

: 152-74-9
Rose-Bengale

: C₃₂H₃₀N₄O₅

: FLTX₁-RB

Guidance literature:: With dmap; O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 18h; Inert atmosphere;
DOI:10.3390/ijms22105339

Reference yield: 31.7%

: 152-74-9
Rose-Bengale

: 141-43-5
ethanolamine

: 2,3,4,5-tetrachloro-6-(6-hydroxy-2,4,5,7-tetraiodo-3-oxo-3H-xanthen-9-yl)-N-(2-hydroxyethyl)-benzamide

Guidance literature:: Rose-Bengale; With O-(1H-benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 4h;

ethanolamine; In N,N-dimethyl-formamide; at 20 ℃;