AG00168U

1218790-33-0 | 2,3-Dihydro-1H-indene-4,6-diboronic acid, pinacol ester

AG00168U

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CAS Number	1218790-33-0
Catalog Number	AG00168U(AGN-PC-0WA5KK)
Chemical Name	2,3-Dihydro-1H-indene-4,6-diboronic acid, pinacol ester
IUPAC Name	4,4,5,5-tetramethyl-2-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,3-dihydro-1H-inden-4-yl]-1,3,2-dioxaborolane
InChI	InChI=1S/C21H32B2O4/c1-18(2)19(3,4)25-22(24-18)15-12-14-10-9-11-16(14)17(13-15)23-26-20(5,6)21(7,8)27-23/h12-13H,9-11H2,1-8H3
InChI Key	GXBZIEBGOAZWAC-UHFFFAOYSA-N
MDL Number	MFCD15143615
Molecular Formula	C21H32B2O4
Molecular Weight	370.0984
SMILES	CC1(C)OB(OC1(C)C)c1cc2CCCc2c(c1)B1OC(C(O1)(C)C)(C)C
Synonyms	1218790-33-0, 2,2'-(2,3-Dihydro-1H-indene-4,6-diyl)bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane), 2,3-Dihydro-1H-indene-4,6-diboronic acid, pinacol ester, DTXSID50682315, MFCD15143615, AKOS025293795, ZINC169936251, OR361132, A-5637, 1,3,2-Dioxaborolane, 2,2'-(2,3-dihydro-1H-indene-4,6-diyl)bis[4,4,5,5-tetramethyl-, GXBZIEBGOAZWAC-UHFFFAOYSA-N, 2,3-Dihydro-1H-indene-4,6-diboronic acid pinacol ester, 2,3-Dihydro-1H-indene-4,6-diboronic acid,pinacol ester,

Complexity	557
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	370.249g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	370.103g/mol
Monoisotopic Mass	370.249g/mol
Rotatable Bond Count	2
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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