Chem
J-GLOBAL ID:200907056216474347
Nikkaji number:J1.515.023H
4-[[(2S)-2-Fluorooctyl]oxy]-4′-[10-(2-thienylacetyloxy)decyloxy]biphenyl
4-[[(2S)-2-フルオロオクチル]オキシ]-4′-[10-(2-チエニルアセチルオキシ)デシルオキシ]ビフェニル
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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:
C36 H49 FO4 S
Molecular formula furigana:
C36-H49-F-O4-S
Molecular weight:
596.840
InChI:
InChI=1S/C36H49FO4S/c1-2-3-4-11-15-32(37)29-41-34-23-19-31(20-24-34)30-17-21-33(22-18-30)39-25-12-9-7-5-6-8-10-13-26-40-36(38)28-35-16-14-27-42-35/h14,16-24,27,32H,2-13,15,25-26,28-29H2,1H3/t32-/m0/s1
InChI key:
KFGBSYXZJJZMSP-YTTGMZPUSA-N
SMILES:
CCCCCC[C@H](F)COc1ccc(cc1)c1ccc(OCCCCCCCCCCOC(=O)Cc2cccs2)cc1
Systematic name (3):
4-[[(2S)-2-フルオロオクチル]オキシ]-4′-[10-(2-チエニルアセチルオキシ)デシルオキシ]ビフェニル
10-[(4'-{[(2S)-2-フルオロオクチル]オキシ}-[1,1'-ビフェニル]-4-イル)オキシ]デシル 2-(チオフェン-2-イル)アセタート
10-[(4'-{[(2S)-2-fluorooctyl]oxy}-[1,1'-biphenyl]-4-yl)oxy]decyl 2-(thiophen-2-yl)acetate
Other name (1):
4-[[(2S)-2-Fluorooctyl]oxy]-4′-[10-(2-thienylacetyloxy)decyloxy]biphenyl
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