AG00IHSD

937591-69-0 | 2,3-Dihydrobenzofuran-5-boronic acid pinacol ester

AG00IHSD

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CAS Number	937591-69-0
Catalog Number	AG00IHSD(AGN-PC-0WA5ME)
Chemical Name	2,3-Dihydrobenzofuran-5-boronic acid pinacol ester
IUPAC Name	2-(2,3-dihydro-1-benzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C14H19BO3/c1-13(2)14(3,4)18-15(17-13)11-5-6-12-10(9-11)7-8-16-12/h5-6,9H,7-8H2,1-4H3
InChI Key	RWJUUXWJBMIGKA-UHFFFAOYSA-N
MDL Number	MFCD09743046
Molecular Formula	C14H19BO3
Molecular Weight	246.1099
SMILES	CC1(C)C(C)(C)OB(C2=CC=C(OCC3)C3=C2)O1
Synonyms	937591-69-0, 2-(2,3-Dihydrobenzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 2,3-Dihydrobenzofuran-5-boronic acid pinacol ester, 2-(2,3-dihydro-1-benzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1-benzofuran, SCHEMBL4427556, DTXSID40587820, RWJUUXWJBMIGKA-UHFFFAOYSA-N, KS-00000Q0C, ANW-53440, MFCD09743046, AKOS015999413, ZINC169747480, QC-8325, AK-92859, DS-17698, ST2403800, TC-142185, 4CH-018366, CS-0041481, A-3428, Z2469998057, (2,3-DIHYDROBENZOFURAN-5-YL)BORONIC ACID PINACOL ESTER, 2-(2,3-Dihydrobenzo[b]furan-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,

Complexity	313
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	246.143g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	246.113g/mol
Monoisotopic Mass	246.143g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	27.7A^2
Undefined Atom Stereocenter Count	0
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

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