913835-75-3 Purity
98%
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Specification
The molecular formula of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is C10H14BNO4S.
The molecular weight of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is 255.10 g/mol.
The IUPAC name of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is (2-pyrrolidin-1-ylsulfonylphenyl)boronic acid.
The InChI of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is InChI=1S/C10H14BNO4S/c13-11(14)9-5-1-2-6-10(9)17(15,16)12-7-3-4-8-12/h1-2,5-6,13-14H,3-4,7-8H2.
The InChIKey of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is ONRDSHCJDLWHKN-UHFFFAOYSA-N.
The canonical SMILES of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is B(C1=CC=CC=C1S(=O)(=O)N2CCCC2)(O)O.
The CAS number of 2-(Pyrrolidinylsulfonyl)phenylboronic acid is 913835-83-3.
There are 2 hydrogen bond donor counts in 2-(Pyrrolidinylsulfonyl)phenylboronic acid.
There are 5 hydrogen bond acceptor counts in 2-(Pyrrolidinylsulfonyl)phenylboronic acid.
Reference: [1]Patent: WO2011/107585,2011,A1 .Location in patent: Page/Page column 115-116
* For details of the synthesis route, please refer to the original source to ensure accuracy.