AG0037Z3

1111096-20-8 | 2-(4-Chloro-3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

AG0037Z3

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CAS Number	1111096-20-8
Catalog Number	AG0037Z3(AGN-PC-0WAA8V)
Chemical Name	2-(4-Chloro-3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name	2-(4-chloro-3,5-dimethylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C14H20BClO2/c1-9-7-11(8-10(2)12(9)16)15-17-13(3,4)14(5,6)18-15/h7-8H,1-6H3
InChI Key	RDHCSMWEYOUZIO-UHFFFAOYSA-N
MDL Number	MFCD12405360
Molecular Formula	C14H20BClO2
Molecular Weight	266.5714
SMILES	ClC1=C(C=C(C=C1C)B1OC(C(O1)(C)C)(C)C)C
Synonyms	1111096-20-8, 2-(4-CHLORO-3,5-DIMETHYLPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE, 4-chloro-3,5-dimethylphenylboronic acid, pinacol ester, SCHEMBL15261973, CTK8C1230, DTXSID10682230, RDHCSMWEYOUZIO-UHFFFAOYSA-N, ANW-66087, MFCD12405360, AKOS016004716, ZINC169935963, FT-0725150, X1618, A-4928, 4-Chloro-35-dimethylphenylboronic acid pinacol ester, 3,5-Dimethyl-4-chlorophenylboronic acid pinacol ester, 4-Chloro-3,5-dimethylphenylboronic acid pinacol ester, 2-chloro-1,3-dimethyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzene, 2-cloro-1,3-dimethyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-benzene, C14H20BClO2, 942069-73-0,

Complexity	291
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	266.124g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	266.572g/mol
Monoisotopic Mass	266.124g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	18.5A^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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