Chem
J-GLOBAL ID：201207068800841649
Nikkaji number：J3.081.700A
5-(2,5-Dimethylphenylethynyl)-11-[2,5-bis(dodecyloxy)-4-(2,5-dimethylphenylethynyl)phenylethynyl]tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
5-(2,5-ジメチルフェニルエチニル)-11-[2,5-ビス(ドデシルオキシ)-4-(2,5-ジメチルフェニルエチニル)フェニルエチニル]トリシクロ[8.2.2.24,7]ヘキサデカ-1(12),4,6,10,13,15-ヘキサエン
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
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
Molecular formula： C68H84O2
Molecular formula furigana： C68-H84-O2
Molecular weight： 933.418
InChI：
InChI=1S/C68H84O2/c1-7-9-11-13-15-17-19-21-23-25-45-69-67-52-66(68(70-46-26-24-22-20-18-16-14-12-10-8-2)51-65(67)43-40-62-48-54(4)28-30-56(62)6)44-42-64-50-58-32-36-59-35-31-57(33-37-60(64)38-34-58)49-63(59)41-39-61-47-53(3)27-29-55(61)5/h27-31,34-35,38,47-52H,7-26,32-33,36-37,45-46H2,1-6H3
InChI key：
IJKUNRCHKFBVEG-UHFFFAOYSA-N
SMILES：
CCCCCCCCCCCCOc1cc(C#Cc2cc3CCc4ccc(CCc2cc3)cc4C#Cc2cc(C)ccc2C)c(OCCCCCCCCCCCC)cc1C#Cc1cc(C)ccc1C
Systematic name (5)：
- 14-[(2,5-ジメチルフェニル)エチニル]-5-[[2,5-ビス(ドデシルオキシ)-4-[(2,5-ジメチルフェニル)エチニル]フェニル]エチニル]トリシクロ[8.2.2.24,7]ヘキサデカン-1(12),4,6,10,13,15-ヘキサエン
- 5-(2,5-ジメチルフェニルエチニル)-11-[2,5-ビス(ドデシルオキシ)-4-(2,5-ジメチルフェニルエチニル)フェニルエチニル]トリシクロ[8.2.2.24,7]ヘキサデカ-1(12),4,6,10,13,15-ヘキサエン
- 5-[2,5-ビス(ドデシルオキシ)-4-(2,5-ジメチルフェニルエチニル)フェニルエチニル]-11-(2,5-ジメチルフェニルエチニル)トリシクロ[8.2.2.24,7]ヘキサデカ-1(12),4,6,10,13,15-ヘキサエン
- 13-[2-(2,5-ジメチルフェニル)エチニル]-15-(2-{4-[2-(2,5-ジメチルフェニル)エチニル]-2,5-ビス(ドデシルオキシ)フェニル}エチニル)トリシクロ[8.2.2.24,7]ヘキサデカ-1(12),4,6,10,13,15-ヘキサエン
- 13-[2-(2,5-dimethylphenyl)ethynyl]-15-(2-{4-[2-(2,5-dimethylphenyl)ethynyl]-2,5-bis(dodecyloxy)phenyl}ethynyl)tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
- 14-[(2,5-Dimethylphenyl)ethynyl]-5-[[2,5-bis(dodecyloxy)-4-[(2,5-dimethylphenyl)ethynyl]phenyl]ethynyl]tricyclo[8.2.2.24,7]hexadecane-1(12),4,6,10,13,15-hexaene
- 5-(2,5-Dimethylphenylethynyl)-11-[2,5-bis(dodecyloxy)-4-(2,5-dimethylphenylethynyl)phenylethynyl]tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
- 5-[2,5-Bis(dodecyloxy)-4-(2,5-dimethylphenylethynyl)phenylethynyl]-11-(2,5-dimethylphenylethynyl)tricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
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