2-Ethylhexyl 4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylate
Catalog Number
ACM1237479387
CAS
1237479-38-7
IUPAC Name
2-ethylhexyl 4,6-dibromo-3-fluorothieno[2,3-c]thiophene-2-carboxylate
Synonyms
4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylic Acid 2-Ethylhexyl Ester
Molecular Weight
472.23
Molecular Formula
C15H17Br2FO2S2
Product Information
Canonical SMILES
CCCCC(CC)COC(=O)C1=C(C2=C(SC(=C2S1)Br)Br)F
InChI
InChI=1S/C15H17Br2FO2S2/c1-3-5-6-8(4-2)7-20-15(19)12-10(18)9-11(21-12)14(17)22-13(9)16/h8H,3-7H2,1-2H3
InChI Key
SOEJTOAKIMQIGL-UHFFFAOYSA-N
Melting Point
39 °C
Purity
>97.0%(GC)
Appearance
Light yellow to Yellow to Orange powder to crystaline
Storage
0-10°C
Complexity
389
Exact Mass
471.90003g/mol
Heavy Atom Count
22
MDL Number
MFCD26403656
Monoisotopic Mass
469.90208g/mol
Reaxys Registry Number
21362447
Rotatable Bond Count
8
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