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n-Octyl 4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylate
Catalog Number
ACM1160823766
CAS
1160823-76-6
IUPAC Name
octyl 4,6-dibromo-3-fluorothieno[2,3-c]thiophene-2-carboxylate
Synonyms
4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylic Acid n-Octyl Ester
Molecular Weight
472.23
Molecular Formula
C15H17Br2FO2S2
Product Information
Canonical SMILES
CCCCCCCCOC(=O)C1=C(C2=C(SC(=C2S1)Br)Br)F
InChI
InChI=1S/C15H17Br2FO2S2/c1-2-3-4-5-6-7-8-20-15(19)12-10(18)9-11(21-12)14(17)22-13(9)16/h2-8H2,1H3
InChI Key
AXLMQOPQPUEOQD-UHFFFAOYSA-N
Melting Point
55 °C
Purity
>94.0%(GC)
Appearance
Light yellow to Brown to Dark green powder to crystal
Complexity
376
Exact Mass
471.90003g/mol
Heavy Atom Count
22
MDL Number
MFCD19940962
Monoisotopic Mass
469.90208g/mol
Reaxys Registry Number
19683097
Rotatable Bond Count
9
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