Chem
J-GLOBAL ID:200907054412945681   Nikkaji number:J2.389.368A

1,4,6,8,9,10,11,13-Octaethylpentacene-2,3-dicarboxylic acid dimethyl ester

1,4,6,8,9,10,11,13-オクタエチルペンタセン-2,3-ジカルボン酸ジメチル
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: C42H50O4
Molecular formula furigana: C42-H50-O4
Molecular weight: 618.858
InChI: InChI=1S/C42H50O4/c1-11-23-24(12-2)26(14-4)32-20-34-28(16-6)36-22-38-30(18-8)40(42(44)46-10)39(41(43)45-9)29(17-7)37(38)21-35(36)27(15-5)33(34)19-31(32)25(23)13-3/h19-22H,11-18H2,1-10H3
InChI key: JUQGVUMIWYRRHE-UHFFFAOYSA-N
SMILES: CCc1c(CC)c(CC)c2cc3c(CC)c4cc5c(CC)c(C(=O)OC)c(C(=O)OC)c(CC)c5cc4c(CC)c3cc2c1CC
Systematic name  (3):
  • 1,4,6,8,9,10,11,13-オクタエチルペンタセン-2,3-ジカルボン酸ジメチル
  • 2,3-ジメチル 1,4,6,8,9,10,11,13-オクタエチルペンタセン-2,3-ジカルボキシラート
  • 2,3-dimethyl 1,4,6,8,9,10,11,13-octaethylpentacene-2,3-dicarboxylate
Other name (1):
  • 1,4,6,8,9,10,11,13-Octaethylpentacene-2,3-dicarboxylic acid dimethyl ester
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