Chem
J-GLOBAL ID:200907070677391764
Nikkaji number:J2.235.382I
1,4-Bis[(E)-4-[(E)-2,5-bis(hexyloxy)-4-[(E)-styryl]styryl]styryl]-2,5-bis(hexyloxy)benzene
1,4-ビス[(E)-4-[(E)-2,5-ビス(ヘキシルオキシ)-4-[(E)-スチリル]スチリル]スチリル]-2,5-ビス(ヘキシルオキシ)ベンゼン
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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:
C90 H114 O6
Molecular formula furigana:
C90-H114-O6
Molecular weight:
1291.896
InChI:
InChI=1S/C90H114O6/c1-7-13-19-31-61-91-85-69-81(87(93-63-33-21-15-9-3)67-79(85)55-49-73-37-27-25-28-38-73)57-51-75-41-45-77(46-42-75)53-59-83-71-90(96-66-36-24-18-12-6)84(72-89(83)95-65-35-23-17-11-5)60-54-78-47-43-76(44-48-78)52-58-82-70-86(92-62-32-20-14-8-2)80(56-50-74-39-29-26-30-40-74)68-88(82)94-64-34-22-16-10-4/h25-30,37-60,67-72H,7-24,31-36,61-66H2,1-6H3/b55-49+,56-50+,57-51+,58-52+,59-53+,60-54+
InChI key:
IIHGSMQYBAFPAO-BVDMZCPMSA-N
SMILES:
CCCCCCOc1cc(/C=C/c2ccc(/C=C/c3cc(OCCCCCC)c(/C=C/c4ccc(/C=C/c5cc(OCCCCCC)c(/C=C/c6ccccc6)cc5OCCCCCC)cc4)cc3OCCCCCC)cc2)c(OCCCCCC)cc1/C=C/c1ccccc1
Systematic name (3):
1,4-ビス[(E)-4-[(E)-2,5-ビス(ヘキシルオキシ)-4-[(E)-スチリル]スチリル]スチリル]-2,5-ビス(ヘキシルオキシ)ベンゼン
1-[(1E)-2-{4-[(1E)-2-{4-[(1E)-2-{4-[(1E)-2-[2,5-ビス(ヘキシルオキシ)-4-[(1E)-2-フェニルエテニル]フェニル]エテニル]フェニル}エテニル]-2,5-ビス(ヘキシルオキシ)フェニル}エテニル]フェニル}エテニル]-2,5-ビス(ヘキシルオキシ)-4-[(1E)-2-フェニルエテニル]ベンゼン
1-[(1E)-2-{4-[(1E)-2-{4-[(1E)-2-{4-[(1E)-2-[2,5-bis(hexyloxy)-4-[(1E)-2-phenylethenyl]phenyl]ethenyl]phenyl}ethenyl]-2,5-bis(hexyloxy)phenyl}ethenyl]phenyl}ethenyl]-2,5-bis(hexyloxy)-4-[(1E)-2-phenylethenyl]benzene
Other name (1):
1,4-Bis[(E)-4-[(E)-2,5-bis(hexyloxy)-4-[(E)-styryl]styryl]styryl]-2,5-bis(hexyloxy)benzene
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