Alternative Energy / Alfa Chemistry

4,7-Bis(5-bromothiophen-2-yl)-5,6-bis(n-octyloxy)-2,1,3-benzothiadiazole

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Products

4,7-Bis(5-bromothiophen-2-yl)-5,6-bis(n-octyloxy)-2,1,3-benzothiadiazole

Catalog Number
ACM1192352105
CAS
1192352-10-5
IUPAC Name
4,7-bis(5-bromothiophen-2-yl)-5,6-dioctoxy-2,1,3-benzothiadiazole
Molecular Weight
714.63
Molecular Formula
C30H38Br2N2O2S3

Product Information

Canonical SMILES
CCCCCCCCOC1=C(C2=NSN=C2C(=C1OCCCCCCCC)C3=CC=C(S3)Br)C4=CC=C(S4)Br
InChI
InChI=1S/C30H38Br2N2O2S3/c1-3-5-7-9-11-13-19-35-29-25(21-15-17-23(31)37-21)27-28(34-39-33-27)26(22-16-18-24(32)38-22)30(29)36-20-14-12-10-8-6-4-2/h15-18H,3-14,19-20H2,1-2H3
InChI Key
QNBPEQCRDXBBCR-UHFFFAOYSA-N
Melting Point
74 °C
Purity
>98.0%(HPLC)
Appearance
Light yellow to Brown powder to crystal
Complexity
630
Exact Mass
714.04417g/mol
Heavy Atom Count
39
MDL Number
MFCD26743666
Monoisotopic Mass
712.04622g/mol
Reaxys Registry Number
19888599
Rotatable Bond Count
18
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