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1207638-53-6

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1207638-53-6 Structure

1207638-53-6 Structure
IdentificationBack Directory
[Name]

D 358
[CAS]

1207638-53-6
[Synonyms]

D 358
D358>
D358 Dye
D 358 D 358
5-[3-(Carboxymethyl)-5-[[4-[4-(2,2-diphenylethenyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopent[b]indol-7-yl]methylene]-4-oxo-2-thiazoli dinylidene]-4-oxo-2-thioxo-3-thiazolidinedodecanoic acid
3-Thiazolidinedodecanoic acid, 5-[3-(carboxymethyl)-5-[[4-[4-(2,2-diphenylethenyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopent[b]indol-7-yl]methylene]-4-oxo-2-thiazolidinylidene]-4-oxo-2-thioxo-
12-[3-(Carboxymethyl)-5-[[4-[4-(2,2-diphenylvinyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indol-7-yl]methylene]-4,4'-dioxo-2'-thioxo-4,5-dihydro-2'H,3H-[2,5'-bithiazolylidene]-3'(4'H)-yl]dodecanoic Acid
12-((2Z,5E)-3-(Carboxymethyl)-5-((4-(4-(2,2-diphenylvinyl)phenyl)-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indol-7-yl)methylene)-4,4'-dioxo-2'-thioxo-4,5-dihydro-2'H,3H-[2,5'-bithiazolylidene]-3'(4'H)-yl)dodecanoic acid
[Molecular Formula]

C52H53N3O6S3
[MDL Number]

MFCD28053536
[MOL File]

1207638-53-6.mol
[Molecular Weight]

912.19
Chemical PropertiesBack Directory
[form ]

powder to crystal
[color ]

Dark red
[λmax]

532 nm in DMF
[InChIKey]

HXSDFCKKOUCOIZ-DOESQJKTSA-N
[SMILES]

S=C(S/C1=C2N(CC(O)=O)C(/C(S\2)=C\C(C=C3)=CC4=C3N(C5=CC=C(C=C(C6=CC=CC=C6)C7=CC=CC=C7)C=C5)C8C4CCC8)=O)N(CCCCCCCCCCCC(O)=O)C1=O
Safety DataBack Directory
[WGK Germany ]

3
[HS Code ]

2934.10.2000
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

Photosensitive Red-Violet dye having excellent photoelectric conversion efficiency as a metal-free dye.
Efficiency of DSSC device - η > 6.7%
Cell area: 0.25 cm2 (0.5 cm × 0.5 cm)
TiO2 Thickness: 5 μm
TiO2: screen printing
Electrolyte: 0.1 M LiI; 0.05 M I2; 0.6 M Dimethyl propylimidazolium
Iodide; 0.05 M t-Butylpyridine in 3-Methoxypropionitrile
Light source: AM1.5
Counter Electrode: Pt/Cr spatter glass
Dye adsorption: 30 °C/ in 3 hr. (t-BuOH/acetonitrile soln.)
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