CAS
945379-33-9 Purity
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945379-33-9 Purity
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The molecular formula is C8H6BrNOS.
It was created on October 30, 2011.
The InChIKey is YQBFLJQXISSAEQ-UHFFFAOYSA-N.
The XLogP3-AA value is 3.1.
It has 3 hydrogen bond acceptors.
The exact mass is 242.93535 g/mol.
No, it has 0 defined atom stereocenter count.
The topological polar surface area is 54.3 Ų.
It has 1 rotatable bond count.
Yes, the compound is canonicalized.