AG009YK3

1431542-21-0 | 3-Carboxy-4-methylphenylboronic acid pinacol ester

AG009YK3

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1431542-21-0
Catalog Number	AG009YK3(AGN-PC-0WRA56)
Chemical Name	3-Carboxy-4-methylphenylboronic acid pinacol ester
IUPAC Name	2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
InChI	InChI=1S/C14H19BO4/c1-9-6-7-10(8-11(9)12(16)17)15-18-13(2,3)14(4,5)19-15/h6-8H,1-5H3,(H,16,17)
InChI Key	UMMKZTMPOIHDSP-UHFFFAOYSA-N
MDL Number	MFCD24039884
Molecular Formula	C14H19BO4
Molecular Weight	262.1093
SMILES	O=C(O)C1=CC(B2OC(C)(C)C(C)(C)O2)=CC=C1C
Synonyms	1431542-21-0, 2-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid, 2-methyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzoic acid, SCHEMBL2720778, UMMKZTMPOIHDSP-UHFFFAOYSA-N, KS-00000M1J, MFCD24039884, AKOS027420431, ZINC203782853, ACN-046485, AK468039, DS-18841, CS-0041335, FT-0731741, 3-Carboxy-4-methylphenylboronic acid pinacol ester, 6-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid,

Complexity	351
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	262.138g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	262.112g/mol
Monoisotopic Mass	262.138g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number