AG00IHD3

928657-21-0 | 4-(Pyrrolidinylsulfonyl)phenylboronic acid, pinacol ester

AG00IHD3

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CAS Number	928657-21-0
Catalog Number	AG00IHD3(AGN-PC-0W1ZJ4)
Chemical Name	4-(Pyrrolidinylsulfonyl)phenylboronic acid, pinacol ester
IUPAC Name	1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonylpyrrolidine
InChI	InChI=1S/C16H24BNO4S/c1-15(2)16(3,4)22-17(21-15)13-7-9-14(10-8-13)23(19,20)18-11-5-6-12-18/h7-10H,5-6,11-12H2,1-4H3
InChI Key	CGWAPBFNKZWFBE-UHFFFAOYSA-N
MDL Number	MFCD06795670
Molecular Formula	C16H24BNO4S
Molecular Weight	337.2421
SMILES	O=S(N1CCCC1)(C2=CC=C(B3OC(C)(C)C(C)(C)O3)C=C2)=O
Synonyms	928657-21-0, 4-(Pyrrolidine-1-sulfonyl)phenylboronic acid, pinacol ester, 1-((4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)sulfonyl)pyrrolidine, 4-(Pyrrolidinylsulfonyl)phenylboronic acid, pinacol ester, 4-(1-Pyrrolidylsulfonyl)phenylboronic Acid Pinacol Ester, 4-(Pyrrolidine-1-sulfonyl)phenylboronic acid pinacol ester, SCHEMBL1367859, CTK8B3959, DTXSID40590410, CGWAPBFNKZWFBE-UHFFFAOYSA-N, BM331, ZXBA000283, ANW-43552, MFCD06795670, AKOS015960131, ZINC169794297, AB29216, RTR-029090, BC000661, OR361595, SY023481, AX8227837, TR-029090, MFCD06795670 (95%), B-3911, J-513860, 4-(Pyrrolidinylsulfonyl)phenylboronic acid pinacol ester, 4-(pyrrolidine-1-sulfonyl)phenylboronic acid, pinacol ester, AldrichCPR, 1-[4-(-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL) BENZENESULFONYL]PYRROLIDINE, 1-[4-(4,4,5,5,-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonyl]pyrrolidine, 1-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonyl]pyrrolidine, Pyrrolidine,1-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]sulfonyl]-, 1-{[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-sulfonyl}pyrrolidine,

Complexity	513
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	337.152g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	337.241g/mol
Monoisotopic Mass	337.152g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	64.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number