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  • 2,5-Bis(2-ethylhexyl)-3,6-di(2-thienyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione

  • 2,5-Bis(2-ethylhexyl)-3,6-di(2-thienyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione

    Catalog Number
    ACM1185885862-2
    CAS Number
    1185885-86-2
    Product Name
    2,5-Bis(2-ethylhexyl)-3,6-di(2-thienyl)-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione
    Structure
    Category
    Polymers; Semiconductor Blocks
    IUPAC Name
    2,5-bis(2-ethylhexyl)-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione
    Molecular Weight
    524.78
    Molecular Formula
    C30H40N2O2S2
    Canonical SMILES
    CCCCC(CC)CN1C(=C2C(=C(N(C2=O)CC(CC)CCCC)C3=CC=CS3)C1=O)C4=CC=CS4
    InChI
    InChI=1S/C30H40N2O2S2/c1-5-9-13-21(7-3)19-31-27(23-15-11-17-35-23)25-26(29(31)33)28(24-16-12-18-36-24)32(30(25)34)20-22(8-4)14-10-6-2/h11-12,15-18,21-22H,5-10,13-14,19-20H2,1-4H3
    InChI Key
    BTJNHAWTSFHBBN-UHFFFAOYSA-N
    Purity
    >98.0%(HPLC)
    Appearance
    Light yellow to Amber to Dark green powder to crystal
    Complexity
    797
    Covalently-Bonded Unit Count
    1
    Exact Mass
    524.253121g/mol
    Formal Charge
    0
    Heavy Atom Count
    36
    MDL Number
    MFCD22200076
    Monoisotopic Mass
    524.253121g/mol
    Rotatable Bond Count
    14
    XLogP3
    7.9
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