AG003KD9

850568-69-3 | 3-(Tetrahydropyran-2-yloxy)phenylboronic acid, pinacol ester

AG003KD9

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CAS Number	850568-69-3
Catalog Number	AG003KD9(AGN-PC-03GVS4)
Chemical Name	3-(Tetrahydropyran-2-yloxy)phenylboronic acid, pinacol ester
IUPAC Name	4,4,5,5-tetramethyl-2-[3-(oxan-2-yloxy)phenyl]-1,3,2-dioxaborolane
InChI	InChI=1S/C17H25BO4/c1-16(2)17(3,4)22-18(21-16)13-8-7-9-14(12-13)20-15-10-5-6-11-19-15/h7-9,12,15H,5-6,10-11H2,1-4H3
InChI Key	RIOLVUFARFCCCE-UHFFFAOYSA-N
MDL Number	MFCD06659834
Molecular Formula	C17H25BO4
Molecular Weight	304.1890
SMILES	CC1(C)OB(OC1(C)C)C1=CC(OC2CCCCO2)=CC=C1
Synonyms	850568-69-3, 4,4,5,5-tetramethyl-2-(3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)-1,3,2-dioxaborolane, 3-(tetrahydro-2H-pyran-2-yloxy)phenylboronic acid pinacol ester, 3-(TETRAHYDROPYRAN-2-YLOXY)PHENYLBORONIC ACID, PINACOL ESTER, SCHEMBL1118822, CTK8B3126, DTXSID80619073, RIOLVUFARFCCCE-UHFFFAOYSA-N, ACT11285, ZX-AT008317, ANW-41812, MFCD06659834, OR4121, AKOS015968943, AB26435, AM62779, EBD1957733, QC-4856, RTR-026529, TRA0023668, AK-81456, BC000821, AB0009858, AX8080974, TR-026529, 4CH-003176, FT-0658832, ST24042533, B-5633, 3-(2-Tetrahydro-2H-pyran-2-yloxy)benzeneboronic acid, 2-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]oxane, 3-(2-TETRAHYDRO-2H-PYRANOXY)PHENYLBORONIC ACID PINACOL ESTER, 3-(2-TETRAHYDROPYRANYLOXY)BENZENEBORONIC ACID PINACOL ESTER, 3-(Tetrahydro-2H-pyran-2-yloxy)phenylboronic acid pinacol ester, AldrichCPR, 4,4,5,5-tetramethyl-2-[3-(oxan-2-yloxy)phenyl]-1,3,2-dioxaborolane, 2-{[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]oxy}tetrahydro-2H-pyran, 2H-Pyran, tetrahydro-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-, 4,4,5,5-Tetramethyl-2-(3-(tetrahydro-2H -pyran-2-yloxy)phenyl)-1,3,2-dioxaborolane, 4,4,5,5-tetramethyl-2-(3-(tetrahydro-2H-pyran-2-yloxy)phenyl)-1,3,2-dioxaborolane, Tetrahydro-2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy]-2H-pyran, C17H25BO4,

Complexity	369
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	304.185g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	304.193g/mol
Monoisotopic Mass	304.185g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	36.9A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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