Chem
J-GLOBAL ID:200907018368013060   Nikkaji number:J2.636.043I

2,5-Dibromo-8,9-dioctyl-3,4-dithiabenzo[e]-as-indacene

2,5-ジブロモ-8,9-ジオクチル-3,4-ジチアベンゾ[e]-as-インダセン
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: C30H38Br2S2
Molecular formula furigana: C30-H38-BR2-S2
Molecular weight: 622.560
InChI: InChI=1S/C30H38Br2S2/c1-3-5-7-9-11-13-15-21-17-23-24(18-22(21)16-14-12-10-8-6-4-2)26-20-28(32)34-30(26)29-25(23)19-27(31)33-29/h17-20H,3-16H2,1-2H3
InChI key: NEIHLCNIORSIHZ-UHFFFAOYSA-N
SMILES: CCCCCCCCc1cc2c3cc(Br)sc3c3sc(Br)cc3c2cc1CCCCCCCC
Systematic name  (3):
  • 2,5-ジブロモ-8,9-ジオクチル-3,4-ジチアベンゾ[e]-as-インダセン
  • 4,9-ジブロモ-14,15-ジオクチル-5,8-ジチアテトラシクロ[10.4.0.02,6.07,11]ヘキサデカ-1(16),2(6),3,7(11),9,12,14-ヘプタエン
  • 4,9-dibromo-14,15-dioctyl-5,8-dithiatetracyclo[10.4.0.02,6.07,11]hexadeca-1(16),2(6),3,7(11),9,12,14-heptaene
Other name (1):
  • 2,5-Dibromo-8,9-dioctyl-3,4-dithiabenzo[e]-as-indacene
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