CAS
957061-89-1 Purity
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957061-89-1 Purity
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The molecular formula is C10H14BNO5S.
It was created on July 21, 2009.
The IUPAC name is (2-morpholin-4-ylsulfonylphenyl)boronic acid.
The Canonical SMILES is B(C1=CC=CC=C1S(=O)(=O)N2CCOCC2)(O)O.
The InChIKey is BZFBAPLYGJEVGH-UHFFFAOYSA-N.
It has 2 hydrogen bond donor counts.
The exact mass is 271.0685739 g/mol.
It has 3 rotatable bond counts.
The topological polar surface area is 95.4 Ų.
Yes, it is canonicalized in PubChem.