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2304444-53-7

2304444-53-7 Structure

2304444-53-7 Structure
IdentificationBack Directory
[Name]

12,13-bis(2-ethylhexyl)-3,9-diundecyl-12,13-dihydro-[1,2,5]thiadiazolo[3,4-e]thieno[2'',3'':4',5']thieno[2',3':4,5]pyrrolo[3,2-g]thieno[2',3':4,5]thieno[3,2-b]indole-2,10-dicarbaldehyde
[CAS]

2304444-53-7
[Synonyms]

PM376
S6801
Y6-CHO
TPBT-CHO
TPB26-CHO
TTP-TTI-2CHO
C11TT(N-EH)BT-CHO
12,13-BIS(2-ETHYLHEXYL)-3,9-DIUNDECYL-12,13-DIHYDRO-[1,2,5]THIADIAZOLO[3,4-E]THIENO[2'',3'':4',5']TH
Dithieno[2'',3'':4',5']thieno[2',3':4,5]pyrrolo[3,2-e:2',3'-g][2,1,3]benzothiadiazole-2,10-dicarboxaldehyde, 12,13-bis(2-ethylhexyl)-12,13-dihydro-3,9-diundecyl-
12,13-bis(2-ethylhexyl)-3,9-diundecyl-12,13-dihydro-[1,2,5]thiadiazolo[3,4-e]thieno[2'',3'':4',5']thieno[2',3':4,5]pyrrolo[3,2-g]thieno[2',3':4,5]thieno[3,2-b]indole-2,10-dicarbaldehyde
[Molecular Formula]

C58H82N4O2S5
[MDL Number]

MFCD32695489
[MOL File]

2304444-53-7.mol
[Molecular Weight]

1027.62
Chemical PropertiesBack Directory
[Boiling point ]

959.0±65.0 °C(Predicted)
[density ]

1.24±0.1 g/cm3(Predicted)
[form ]

powder
[pka]

-1.24±0.30(Predicted)
[color ]

Orange red
[InChIKey]

QSBHLTYFYHPIFC-UHFFFAOYSA-N
[SMILES]

N1(CC(CC)CCCC)C2=C(C3=NSN=C3C3C4SC5C(CCCCCCCCCCC)=C(C=O)SC=5C=4N(CC(CC)CCCC)C=32)C2SC3C(CCCCCCCCCCC)=C(C=O)SC=3C1=2
[Odor]

Orange red powder
Hazard InformationBack Directory
[Description]

TTP-TTI-2CHO contains a rigid core of thienothienopyrrolo-thienothienoindole (TTP-TTI) with large side alkyl chains which help for solubility. It could also be considered as highly symmetrical with benzothiadiazole centre fused with two identical?thienothienopyrrole units (BTP).
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