Chem
J-GLOBAL ID：200907058688638915   Nikkaji number：J1.732.308C

6,13-Bis(3,3-dimethyl-1-butynyl)pentacene

6,13-ビス(3,3-ジメチル-1-ブチニル)ペンタセン
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： C34H30
Molecular formula furigana： C34-H30
Molecular weight： 438.614
InChI： InChI=1S/C34H30/c1-33(2,3)17-15-27-29-19-23-11-7-9-13-25(23)21-31(29)28(16-18-34(4,5)6)32-22-26-14-10-8-12-24(26)20-30(27)32/h7-14,19-22H,1-6H3
InChI key： LQTMQUBGAXVHME-UHFFFAOYSA-N
SMILES： CC(C)(C)C#Cc1c2cc3ccccc3cc2c(C#CC(C)(C)C)c2cc3ccccc3cc12
Systematic name  (3)：
  • 6,13-ビス(3,3-ジメチル-1-ブチニル)ペンタセン
  • 6,13-ビス(3,3-ジメチルブタ-1-イン-1-イル)ペンタセン
  • 6,13-bis(3,3-dimethylbut-1-yn-1-yl)pentacene
Other name (1)：
  • 6,13-Bis(3,3-dimethyl-1-butynyl)pentacene
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