Chem
J-GLOBAL ID：200907053452101951   Nikkaji number：J2.389.364I

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

1,4,6,13-テトラプロピル-8,9,10,11-テトラエチルペンタセン-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： C46H58O4
Molecular formula furigana： C46-H58-O4
Molecular weight： 674.966
InChI： InChI=1S/C46H58O4/c1-11-19-31-37-23-35-29(17-7)27(15-5)28(16-6)30(18-8)36(35)24-38(37)32(20-12-2)40-26-42-34(22-14-4)44(46(48)50-10)43(45(47)49-9)33(21-13-3)41(42)25-39(31)40/h23-26H,11-22H2,1-10H3
InChI key： QSABFWQFIJIULB-UHFFFAOYSA-N
SMILES： CCCc1c(C(=O)OC)c(C(=O)OC)c(CCC)c2cc3c(CCC)c4cc5c(CC)c(CC)c(CC)c(CC)c5cc4c(CCC)c3cc12
Systematic name  (3)：
  • 1,4,6,13-テトラプロピル-8,9,10,11-テトラエチルペンタセン-2,3-ジカルボン酸ジメチル
  • 2,3-ジメチル 8,9,10,11-テトラエチル-1,4,6,13-テトラプロピルペンタセン-2,3-ジカルボキシラート
  • 2,3-dimethyl 8,9,10,11-tetraethyl-1,4,6,13-tetrapropylpentacene-2,3-dicarboxylate
Other name (1)：
  • 1,4,6,13-Tetrapropyl-8,9,10,11-tetraethylpentacene-2,3-dicarboxylic acid dimethyl ester
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