Chem
J-GLOBAL ID:200907058241849293
Nikkaji number:J2.508.953G
1,4-Bis[4-(hydroxymethyl)-2,5-bis(dodecyloxy)styryl]-2,5-bis[[(S)-3-methyloctyl]oxy]benzene
1,4-ビス[4-(ヒドロキシメチル)-2,5-ビス(ドデシルオキシ)スチリル]-2,5-ビス[[(S)-3-メチルオクチル]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 H154 O8
Molecular formula furigana:
C90-H154-O8
Molecular weight:
1364.214
InChI:
InChI=1S/C90H154O8/c1-9-15-21-25-29-33-37-41-45-51-63-93-87-73-83(75-91)89(95-65-53-47-43-39-35-31-27-23-17-11-3)71-81(87)59-57-79-69-86(98-68-62-78(8)56-50-20-14-6)80(70-85(79)97-67-61-77(7)55-49-19-13-5)58-60-82-72-90(96-66-54-48-44-40-36-32-28-24-18-12-4)84(76-92)74-88(82)94-64-52-46-42-38-34-30-26-22-16-10-2/h57-60,69-74,77-78,91-92H,9-56,61-68,75-76H2,1-8H3/t77-,78-/m0/s1
InChI key:
WIFCZVTZGMOJRP-KEVOYEFBSA-N
SMILES:
CCCCCCCCCCCCOc1cc(C=Cc2cc(OCC[C@@H](C)CCCCC)c(C=Cc3cc(OCCCCCCCCCCCC)c(CO)cc3OCCCCCCCCCCCC)cc2OCC[C@@H](C)CCCCC)c(OCCCCCCCCCCCC)cc1CO
Systematic name (3):
1,4-ビス[4-(ヒドロキシメチル)-2,5-ビス(ドデシルオキシ)スチリル]-2,5-ビス[[(S)-3-メチルオクチル]オキシ]ベンゼン
{4-[2-(4-{2-[2,5-ビス(ドデシルオキシ)-4-(ヒドロキシメチル)フェニル]エテニル}-2,5-ビス({[(3S)-3-メチルオクチル]オキシ})フェニル)エテニル]-2,5-ビス(ドデシルオキシ)フェニル}メタノール
{4-[2-(4-{2-[2,5-bis(dodecyloxy)-4-(hydroxymethyl)phenyl]ethenyl}-2,5-bis({[(3S)-3-methyloctyl]oxy})phenyl)ethenyl]-2,5-bis(dodecyloxy)phenyl}methanol
Other name (1):
1,4-Bis[4-(hydroxymethyl)-2,5-bis(dodecyloxy)styryl]-2,5-bis[[(S)-3-methyloctyl]oxy]benzene
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