AG009WHE

1313399-38-0 | 2-Methyl-6-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-isoindol-1-one

AG009WHE

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CAS Number	1313399-38-0
Catalog Number	AG009WHE(AGN-PC-0WNGKX)
Chemical Name	2-Methyl-6-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-isoindol-1-one
IUPAC Name	2-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H-isoindol-1-one
InChI	InChI=1S/C15H20BNO3/c1-14(2)15(3,4)20-16(19-14)11-7-6-10-9-17(5)13(18)12(10)8-11/h6-8H,9H2,1-5H3
InChI Key	VBWYOZWWAKZWKG-UHFFFAOYSA-N
MDL Number	MFCD12755781
Molecular Formula	C15H20BNO3
Molecular Weight	273.1352
SMILES	CN1C(C2=CC(=CC=C2C1)B1OC(C(O1)(C)C)(C)C)=O
Synonyms	1313399-38-0, 2-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one, 2-Methyl-6-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-2,3-dihydro-isoindol-1-one, MFCD12755781, SCHEMBL2041419, VBWYOZWWAKZWKG-UHFFFAOYSA-N, BCP17653, KS-00000M3G, AKOS015919143, ZINC198092988, AK476679, DS-18885, DB-012024, CS-0036840, S10-0051, 2-Methyl-(isoindolin-1-one)-6-boronic acid pinacol ester, (2-METHYL-3-OXOISOINDOLIN-5-YL)BORONIC ACID PINACOL ESTER,

Complexity	407
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	273.154g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	273.139g/mol
Monoisotopic Mass	273.154g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	38.8A^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

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