Chem
J-GLOBAL ID：201507007114011340   Nikkaji number：J3.415.478C

2,5,8-Tris[3,5-bis(hexadecyloxy)phenyl]-6a,6b-dihydro-6a,6b-dimethyl-1,6,7-trithia-1H-trindene

2,5,8-トリス[3,5-ビス(ヘキサデシルオキシ)フェニル]-6a,6b-ジヒドロ-6a,6b-ジメチル-1,6,7-トリチア-1H-トリンデン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C128H216O6S3
Molecular formula furigana： C128-H216-O6-S3
Molecular weight： 1947.310
InChI： InChI=1S/C128H216O6S3/c1-9-15-21-27-33-39-45-51-57-63-69-75-81-87-93-129-114-99-111(100-115(105-114)130-94-88-82-76-70-64-58-52-46-40-34-28-22-16-10-2)123-108-120-121-109-124(112-101-116(131-95-89-83-77-71-65-59-53-47-41-35-29-23-17-11-3)106-117(102-112)132-96-90-84-78-72-66-60-54-48-42-36-30-24-18-12-4)136-127(121,7)128(8)122(126(120)135-123)110-125(137-128)113-103-118(133-97-91-85-79-73-67-61-55-49-43-37-31-25-19-13-5)107-119(104-113)134-98-92-86-80-74-68-62-56-50-44-38-32-26-20-14-6/h99-110H,9-98H2,1-8H3
InChI key： OPEREMZNRJBKFQ-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCCCCCOc1cc(OCCCCCCCCCCCCCCCC)cc(c1)C1=CC2=c3cc(sc3=C3C=C(SC3(C)C2(C)S1)c1cc(OCCCCCCCCCCCCCCCC)cc(OCCCCCCCCCCCCCCCC)c1)c1cc(OCCCCCCCCCCCCCCCC)cc(OCCCCCCCCCCCCCCCC)c1
Systematic name  (2)：
  • 6a,6b-ジメチル-2,5,8-トリス[3,5-ビス(ヘキサデシルオキシ)フェニル]-1,6,7-トリチア-6a,6b-ジヒドロ-1H-トリンデン
  • 2,5,8-トリス[3,5-ビス(ヘキサデシルオキシ)フェニル]-6a,6b-ジヒドロ-6a,6b-ジメチル-1,6,7-トリチア-1H-トリンデン
Other name (2)：
  • 6a,6b-Dimethyl-2,5,8-tris[3,5-bis(hexadecyloxy)phenyl]-1,6,7-trithia-6a,6b-dihydro-1H-trindene
  • 2,5,8-Tris[3,5-bis(hexadecyloxy)phenyl]-6a,6b-dihydro-6a,6b-dimethyl-1,6,7-trithia-1H-trindene
Thsaurus map：
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