AG008SIR

1072945-06-2 | 4-Methyl-3-nitrophenylboronic acid, pinacol ester

AG008SIR

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	1072945-06-2
Catalog Number	AG008SIR(AGN-PC-0WAAKE)
Chemical Name	4-Methyl-3-nitrophenylboronic acid, pinacol ester
IUPAC Name	4,4,5,5-tetramethyl-2-(4-methyl-3-nitrophenyl)-1,3,2-dioxaborolane
InChI	InChI=1S/C13H18BNO4/c1-9-6-7-10(8-11(9)15(16)17)14-18-12(2,3)13(4,5)19-14/h6-8H,1-5H3
InChI Key	XYZOZOWGODLRCW-UHFFFAOYSA-N
MDL Number	MFCD09027080
Molecular Formula	C13H18BNO4
Molecular Weight	263.0973
SMILES	c1(c(ccc(c1)B1OC(C(O1)(C)C)(C)C)C)[N+](=O)[O-]
Synonyms	1072945-06-2, 4,4,5,5-TETRAMETHYL-2-(4-METHYL-3-NITROPHENYL)-1,3,2-DIOXABOROLANE, 4-Methyl-3-nitrophenylboronic acid pinacol ester, SCHEMBL4550135, CTK4A5186, DTXSID40674421, XYZOZOWGODLRCW-UHFFFAOYSA-N, ANW-41136, MFCD09027080, AKOS015960132, ZINC169903858, CM-2087, RTR-001503, AB0029380, TR-001503, X1522, A-4497, A801644, J-513975, 4,4,5,5-tetramethyl-2-(4-methyl-3-nitro-phenyl)-1,3,2-dioxaborolane, C13H18BNO4, 4-METHYL-3-NITROPHENYLBORONIC ACID, PINACOL ESTER, 4,4,5,5-Tetramethyl-2-(3-methyl-4-nitrophenyl)-1,3,2-dioxaborolane,

Complexity	350
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.133g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.1g/mol
Monoisotopic Mass	263.133g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	64.3A^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