AG003ET4

325142-93-6 | 3,5-Dimethylphenylphenylboronic acid pinacol ester

AG003ET4

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CAS Number	325142-93-6
Catalog Number	AG003ET4(AGN-PC-0NL4Z5)
Chemical Name	3,5-Dimethylphenylphenylboronic acid pinacol ester
IUPAC Name	2-(3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C14H21BO2/c1-10-7-11(2)9-12(8-10)15-16-13(3,4)14(5,6)17-15/h7-9H,1-6H3
InChI Key	XWCNEQGQJTWRHX-UHFFFAOYSA-N
MDL Number	MFCD10000955
Molecular Formula	C14H21BO2
Molecular Weight	232.1263
SMILES	CC1(C)C(C)(C)OB(C2=CC(C)=CC(C)=C2)O1
Synonyms	2-(3,5-Dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 325142-93-6, (3,5-Dimethylphenyl)boronic acid pinacol ester, ACMC-209hto, AMTB1117, SCHEMBL4020523, CTK4G8819, DTXSID80579284, ANW-27370, MFCD10000955, AKOS015841979, ZINC196003989, AS-3163, TR-013659, 3,5-Dimethylphenylboronic Acid Pinacol Ester, D3533, FT-0737006, I14-62186, 5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-m-xylene, C14H21BO2, 3,5-Dimethylphenylphenylboronic acid pinacol ester,

Complexity	262
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	232.163g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	232.13g/mol
Monoisotopic Mass	232.163g/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	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number