99660-44-3 Purity
96%
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Specification
The molecular formula of 2-Acetyl-3-bromo-benzo[b]thiophene is C10H7BrOS.
2-Acetyl-3-bromo-benzo[b]thiophene was created in PubChem on October 25, 2006.
The IUPAC name of 2-Acetyl-3-bromo-benzo[b]thiophene is 1-(3-bromo-1-benzothiophen-2-yl)ethanone.
The InChIKey of 2-Acetyl-3-bromo-benzo[b]thiophene is QVWNKOMTEBSMMC-UHFFFAOYSA-N.
The molecular weight of 2-Acetyl-3-bromo-benzo[b]thiophene is 255.13 g/mol.
2-Acetyl-3-bromo-benzo[b]thiophene has 2 hydrogen bond acceptor counts.
The topological polar surface area of 2-Acetyl-3-bromo-benzo[b]thiophene is 45.3 Ų.
Yes, 2-Acetyl-3-bromo-benzo[b]thiophene is a canonicalized compound.
2-Acetyl-3-bromo-benzo[b]thiophene has 1 rotatable bond count.
The XLogP3-AA value of 2-Acetyl-3-bromo-benzo[b]thiophene is 3.6.