Chem
J-GLOBAL ID：200907073795139645   Nikkaji number：J2.661.896G

4,4′-[4,5-Bis(dodecyloxy)-o-phenylene]bis(2-methyl-3-butyne-2-ol)

4,4′-[4,5-ビス(ドデシルオキシ)-o-フェニレン]ビス(2-メチル-3-ブチン-2-オール)
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： C40H66O4
Molecular formula furigana： C40-H66-O4
Molecular weight： 610.964
InChI： InChI=1S/C40H66O4/c1-7-9-11-13-15-17-19-21-23-25-31-43-37-33-35(27-29-39(3,4)41)36(28-30-40(5,6)42)34-38(37)44-32-26-24-22-20-18-16-14-12-10-8-2/h33-34,41-42H,7-26,31-32H2,1-6H3
InChI key： UYQKRJPCJYTVKV-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCOc1cc(C#CC(C)(C)O)c(cc1OCCCCCCCCCCCC)C#CC(C)(C)O
Systematic name  (3)：
  • 4,4′-[4,5-ビス(ドデシルオキシ)-o-フェニレン]ビス(2-メチル-3-ブチン-2-オール)
  • 4-[4,5-ビス(ドデシルオキシ)-2-(3-ヒドロキシ-3-メチルブタ-1-イン-1-イル)フェニル]-2-メチルブタ-3-イン-2-オール
  • 4-[4,5-bis(dodecyloxy)-2-(3-hydroxy-3-methylbut-1-yn-1-yl)phenyl]-2-methylbut-3-yn-2-ol
Other name (1)：
  • 4,4′-[4,5-Bis(dodecyloxy)-o-phenylene]bis(2-methyl-3-butyne-2-ol)
Thsaurus map：
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