AG00D9RE

517874-21-4 | 1,4-Benzodioxane-6-boronic acid, pinacol ester

AG00D9RE

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CAS Number	517874-21-4
Catalog Number	AG00D9RE(AGN-PC-0SB5W5)
Chemical Name	1,4-Benzodioxane-6-boronic acid, pinacol ester
IUPAC Name	2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C14H19BO4/c1-13(2)14(3,4)19-15(18-13)10-5-6-11-12(9-10)17-8-7-16-11/h5-6,9H,7-8H2,1-4H3
InChI Key	WIIBAHCYWOUFRM-UHFFFAOYSA-N
MDL Number	MFCD05663890
Molecular Formula	C14H19BO4
Molecular Weight	262.1093
SMILES	CC1(C)OB(OC1(C)C)c1cc2c(cc1)OCCO2
Synonyms	517874-21-4, 2-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 1,4-benzodioxane-6-boronic acid, pinacol ester, 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 1,4-Benzodioxane-6-boronic acid pinacol ester, AC1MC30Z, AMTB908, SCHEMBL14212260, CTK8B4258, DTXSID60375246, WIIBAHCYWOUFRM-UHFFFAOYSA-N, BM223, ANW-44543, MFCD05663890, SBB102511, AKOS015951058, ZINC169743741, AB22036, AS-2970, RTR-018437, KS-000022L0, AB1007809, ST2403803, 4CH-018358, Y9298, Q-7348, A828774, J-503965, 1,4-Benzodioxane-6-boronic acid, pinacol ester, AldrichCPR, (2,3-DIHYDROBENZO[B][1,4]DIOXIN-6-YL)BORONIC ACID PINACOL ESTER, 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,4-benzodioxane, 6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-benzo[1,4]dioxine, 6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1,4-benzodioxine, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2H,3H-benzo[e]1,4-dioxane, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydrobenzo-1,4-dioxine, AldrichCPR, null, C14H19BO4, CID2760592, 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydrobenzo-1,4-dioxoline, 2-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,

Complexity	328
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	0
Isotope Atom Count	0
Molecular Weight	262.112g/mol
Monoisotopic Mass	262.138g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	36.9A^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

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