Chem
J-GLOBAL ID：201507022553305846   Nikkaji number：J3.349.877B

Bis(p-toluenesulfonic acid)oxybis[methylene(3-methoxy-p-phenylene)] ester

ビス(p-トルエンスルホン酸)オキシビス[メチレン(3-メトキシ-p-フェニレン)]
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： C30H30O9S2
Molecular formula furigana： C30-H30-O9-S2
Molecular weight： 598.680
InChI： InChI=1S/C30H30O9S2/c1-21-5-11-25(12-6-21)40(31,32)38-27-15-9-23(17-29(27)35-3)19-37-20-24-10-16-28(30(18-24)36-4)39-41(33,34)26-13-7-22(2)8-14-26/h5-18H,19-20H2,1-4H3
InChI key： MGIWPTPVAZLHAN-UHFFFAOYSA-N
SMILES： COc1cc(COCc2ccc(OS(=O)(=O)c3ccc(C)cc3)c(OC)c2)ccc1OS(=O)(=O)c1ccc(C)cc1
Systematic name  (3)：
  • ビス(p-トルエンスルホン酸)オキシビス[メチレン(3-メトキシ-p-フェニレン)]
  • 2-メトキシ-4-[({3-メトキシ-4-[(4-メチルベンゼンスルホニル)オキシ]フェニル}メトキシ)メチル]フェニル 4-メチルベンゼン-1-スルホナート
  • 2-methoxy-4-[({3-methoxy-4-[(4-methylbenzenesulfonyl)oxy]phenyl}methoxy)methyl]phenyl 4-methylbenzene-1-sulfonate
Other name (1)：
  • Bis(p-toluenesulfonic acid)oxybis[methylene(3-methoxy-p-phenylene)] ester
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