4,7-Bis(5-bromo-4-dodecyl-2-thienyl)-2,1,3-benzothiadiazole

Catalog Number

ACM1179993726-1

CAS

1179993-72-6

IUPAC Name

4,7-bis(5-bromo-4-dodecylthiophen-2-yl)-2,1,3-benzothiadiazole

Molecular Weight

794.85

Molecular Formula

C38H54Br2N2S3

Product Information

Canonical SMILES

CCCCCCCCCCCCC1=C(SC(=C1)C2=CC=C(C3=NSN=C23)C4=CC(=C(S4)Br)CCCCCCCCCCCC)Br

Inchi

InChI=1S/C38H54Br2N2S3/c1-3-5-7-9-11-13-15-17-19-21-23-29-27-33(43-37(29)39)31-25-26-32(36-35(31)41-45-42-36)34-28-30(38(40)44-34)24-22-20-18-16-14-12-10-8-6-4-2/h25-28H,3-24H2,1-2H3

InChIKey

ZFMZIVKXDPTWBS-UHFFFAOYSA-N

Purity

>98.0%(HPLC)

Appearance

Orange to Red powder to crystal

Complexity

703

Heavy Atom Count

Reaxys Registry Number

21912169

Rotatable Bond Count

Monoisotopic Mass

792.18159g/mol

Exact Mass

794.17954g/mol

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4,7-Bis(5-bromo-4-dodecyl-2-thienyl)-2,1,3-benzothiadiazole

Product Information

4,7-Di(2-thienyl)-2,1,3-benzothiadiazole

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