AG003JLK

408492-28-4 | 3-Iodophenylboronic acid, pinacol ester

AG003JLK

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CAS Number	408492-28-4
Catalog Number	AG003JLK(AGN-PC-006L1G)
Chemical Name	3-Iodophenylboronic acid, pinacol ester
IUPAC Name	2-(3-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C12H16BIO2/c1-11(2)12(3,4)16-13(15-11)9-6-5-7-10(14)8-9/h5-8H,1-4H3
InChI Key	HSHFNMSHDHAHDN-UHFFFAOYSA-N
MDL Number	MFCD09953498
Molecular Formula	C12H16BIO2
Molecular Weight	329.9697
SMILES	CC1(C)C(C)(C)OB(C2=CC=CC(I)=C2)O1
Synonyms	408492-28-4, 2-(3-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 3-IODOPHENYLBORONIC ACID PINACOL ESTER, MFCD09953498, 3-Iodo-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene, AMTB088, SCHEMBL15403788, CTK4I3894, DTXSID10462094, ZX-RL002601, AKOS005259446, ZINC169746021, AS-2323, FCH2716586, 3-Iodophenylboronic acid, pinacol ester, KS-000022A1, OR303433, 3-Iodophenylboronic acid pinacol ester,97%, AX8281799, RT-008766, 3-Iodophenylboronic acid pinacol ester, 97%, A-9209, A821941, I01-17429, 1,3,2-Dioxaborolane,2-(3-iodophenyl)-4,4,5,5-tetramethyl-, 2-(3-iodanylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, C12H16BIO2, 3-Iodophenylboronic acid pinacolester, ACN-044242, CID11313483, 33775-94-9,

Complexity	252
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	330.029g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	329.972g/mol
Monoisotopic Mass	330.029g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H413
Packing Group
Precautionary statements	P264-P270-P273-P301+P312-P330
UN Code

Certificate of Analysis

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