2,2′-[[6,6,12,12-Tetrakis(4-hexylphenyl)-6,12-dihydrodithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene-2,8-diyl]bis[methylidyne(6-oxo-4H-cyclopenta[c]thiophene-5,4(6H)-diylidene)]]bis[propanedinitrile] CAS 2099010-84-9

Purity 97%+In StockPharmaceutical Standards
CAS No.2099010-84-9
Molecular FormulaC90H78N4O2S6
Molecular Weight1440.00 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,2′-[[6,6,12,12-Tetrakis(4-hexylphenyl)-6,12-dihydrodithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene-2,8-diyl]bis[methylidyne(6-oxo-4H-cyclopenta[c]thiophene-5,4(6H)-diylidene)]]bis[propanedinitrile] CAS 2099010-84-9 chemical structure

Description

The occurrence of 2,2′-[[6,6,12,12-Tetrakis(4-hexylphenyl)-6,12-dihydrodithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene-2,8-diyl]bis[methylidyne(6-oxo-4H-cyclopenta[c]thiophene-5,4(6H)-diylidene)]]bis[propanedinitrile] is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 2,2′-[[6,6,12,12-Tetrakis(4-hexylphenyl)-6,12-dihydrodithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene-2,8-diyl]bis[methylidyne(6-oxo-4H-cyclopenta[c]thiophene-5,4(6H)-diylidene)]]bis[propanedinitrile] (CAS 2099010-84-9), a certified reference material (molecular formula C90H78N4O2S6, MW 1440.00 g/mol) for analytical method development and quality control.

Structurally, 2,2′-[[6,6,12,12-Tetrakis(4-hexylphenyl)-6,12-dihydrodithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene-2,8-diyl]bis[methylidyne(6-oxo-4H-cyclopenta[c]thiophene-5,4(6H)-diylidene)]]bis[propanedinitrile] (C90H78N4O2S6) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 54.0, corresponding to approximately 54 ring(s) or double-bond equivalent(s). With a molecular weight of 1440.00 g/mol, it falls into the high-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

As a certified reference material (CRM), 2,2′-[[6,6,12,12-Tetrakis(4-hexylphenyl)-6,12-dihydrodithieno[2,3-d:2′,3′-d′]-s-indaceno[1,2-b:5,6-b′]dithiophene-2,8-diyl]bis[methylidyne(6-oxo-4H-cyclopenta[c]thiophene-5,4(6H)-diylidene)]]bis[propanedinitrile] meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC90H78N4O2S6
Molecular Weight1440.00 g/mol
Purity97%+
StorageStore in a cool place (≤25°C), protect from light, keep sealed and dry
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening
Degree of Unsaturation (DBE)54.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1997
Nitrogen Atoms4
Sulfur Atoms6

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