2,5-Bis(1,1-dimethylethyl) 3,6-bis(5-bromo-2-thienyl)-1,4-dioxopyrrolo[3,4-c]pyrrole-2,5(1H,4H)-dicarboxylate

CAS Registry Number®

1046864-84-9

CAS Name

2,5-Bis(1,1-dimethylethyl) 3,6-bis(5-bromo-2-thienyl)-1,4-dioxopyrrolo[3,4-c]pyrrole-2,5(1H,4H)-dicarboxylate

Molecular Formula

C24H22Br2N2O6S2

Molecular Mass

658.38

Cite this Page

2,5-Bis(1,1-dimethylethyl) 3,6-bis(5-bromo-2-thienyl)-1,4-dioxopyrrolo[3,4-c]pyrrole-2,5(1H,4H)-dicarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1046864-84-9 (retrieved 2024-11-22) (CAS RN: 1046864-84-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C24H22Br2N2O6S2/c1-23(2,3)33-21(31)27-17(11-7-9-13(25)35-11)15-16(19(27)29)18(12-8-10-14(26)36-12)28(20(15)30)22(32)34-24(4,5)6/h7-10H,1-6H3

InChIKey

InChIKey=QOZQIPYHXMJDFH-UHFFFAOYSA-N

SMILES

O=C1C=2C(=C(N1C(OC(C)(C)C)=O)C=3SC(Br)=CC3)C(=O)N(C(OC(C)(C)C)=O)C2C=4SC(Br)=CC4

Canonical SMILES

O=C(OC(C)(C)C)N1C(=O)C=2C(C(=O)N(C(=O)OC(C)(C)C)C2C=3SC(Br)=CC3)=C1C=4SC(Br)=CC4

Other Names for this Substance

  • Pyrrolo[3,4-c]pyrrole-2,5(1H,4H)-dicarboxylic acid, 3,6-bis(5-bromo-2-thienyl)-1,4-dioxo-, 2,5-bis(1,1-dimethylethyl) ester
  • 2,5-Bis(1,1-dimethylethyl) 3,6-bis(5-bromo-2-thienyl)-1,4-dioxopyrrolo[3,4-c]pyrrole-2,5(1H,4H)-dicarboxylate

Deleted or Replaced CAS Registry Numbers

2702295-94-9

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