AG00APVR

195062-59-0 | 2-Methylphenylboronic acid, pinacol ester

AG00APVR

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CAS Number	195062-59-0
Catalog Number	AG00APVR(AGN-PC-0N94VQ)
Chemical Name	2-Methylphenylboronic acid, pinacol ester
IUPAC Name	4,4,5,5-tetramethyl-2-(2-methylphenyl)-1,3,2-dioxaborolane
InChI	InChI=1S/C13H19BO2/c1-10-8-6-7-9-11(10)14-15-12(2,3)13(4,5)16-14/h6-9H,1-5H3
InChI Key	NUFSJKMRPYGNHV-UHFFFAOYSA-N
MDL Number	MFCD06795658
Molecular Formula	C13H19BO2
Molecular Weight	218.0998
SMILES	CC1=C(C=CC=C1)B1OC(C)(C)C(C)(C)O1
Synonyms	195062-59-0, 4,4,5,5-Tetramethyl-2-(o-tolyl)-1,3,2-dioxaborolane, 2-Methylphenylboronic acid pinacol ester, 2-METHYLPHENYLBORONIC ACID, PINACOL ESTER, 2-Tolylboronic acid pinacol ester, 4,4,5,5-tetramethyl-2-(2-methylphenyl)-1,3,2-dioxaborolane, 1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-(2-methylphenyl)-, 4,4,5,5-Tetramethyl-2-o-tolyl-1,3,2-dioxaborolane, AMTB428, SCHEMBL6686927, CTK0E1017, DTXSID70443748, NUFSJKMRPYGNHV-UHFFFAOYSA-N, o-Tolylboronic Acid Pinacol Ester, KS-00000P4J, ANW-54558, CT-286, MFCD06795658, AKOS015951135, ZINC169747597, AB29189, AS-2518, CS-W000893, QC-4289, AK-61653, AM808111, AB0009031, AB1008107, TR-009070, 4CH-001162, FT-0686847, ST24042544, A-9094, 2-methylphenylboronic acid, pinacol ester, AldrichCPR, 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)toluene, 2-(2-METHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE, C13H19BO2, ACN-029106, CID10704008, T3195,

Complexity	247
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	218.148g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	218.103g/mol
Monoisotopic Mass	218.148g/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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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