Basic Information |
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Product Name: | 2,5-DIOCTYL-3,6-BIS-(5''-N-HEXYL-[2,2',5',2'']TERTHIOPHEN-5-YL)-PYRROLO[3,4-C]PYRROLE-1,4-DIONE |
CAS: | 1093468-95-1 |
English Synonyms: | SMDPPO ; 2,5-DIOCTYL-3,6-BIS-(5''-N-HEXYL-[2,2',5',2'']TERTHIOPHEN-5-YL)-PYRROLO[3,4-C]PYRROLE-1,4-DIONE |
MDL Number.: | MFCD20036284 |
H bond acceptor: | 4 |
H bond donor: | 0 |
Smile: | CCCCCCCCN1C(=C2C(=C(N(C2=O)CCCCCCCC)c3ccc(s3)c4ccc(s4)c5ccc(s5)CCCCCC)C1=O)c6ccc(s6)c7ccc(s7)c8ccc(s8)CCCCCC |
InChi: | InChI=1S/C58H72N2O2S6/c1-5-9-13-17-19-23-39-59-55(51-37-35-49(67-51)47-33-31-45(65-47)43-29-27-41(63-43)25-21-15-11-7-3)53-54(57(59)61)56(60(58(53)62)40-24-20-18-14-10-6-2)52-38-36-50(68-52)48-34-32-46(66-48)44-30-28-42(64-44)26-22-16-12-8-4/h27-38H,5-26,39-40H2,1-4H3 |
InChiKey: | InChIKey=CAOPCPKFKCIXFB-UHFFFAOYSA-N |
Property |
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Melting Point: | 242-247 DEG C |
Comments: | LOSS: 0.5 WT%, 307 DEG C UV ABSORPTION: 644 NM IN METHYLENE CHLORIDE WGK: 3 |
Safety information |
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WGK Germany: | 3 |
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