AG003CPK

219489-07-3 | (Z)-1-Ethoxyethene-2-boronic acid pinacol ester

AG003CPK

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CAS Number	219489-07-3
Catalog Number	AG003CPK(AGN-PC-0WA332)
Chemical Name	(Z)-1-Ethoxyethene-2-boronic acid pinacol ester
IUPAC Name	2-[(Z)-2-ethoxyethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C10H19BO3/c1-6-12-8-7-11-13-9(2,3)10(4,5)14-11/h7-8H,6H2,1-5H3/b8-7-
InChI Key	MRAYNLYCQPAZJN-FPLPWBNLSA-N
MDL Number	MFCD09702441
Molecular Formula	C10H19BO3
Molecular Weight	198.0671
SMILES	CC1(C)C(C)(C)OB(/C=C\\OCC)O1
Synonyms	219489-07-3, (Z)-2-(2-ethoxyvinyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, (Z)-1-Ethoxyethene-2-boronic acid pinacol ester, J-501826, J-502577, 2-[(Z)-2-Ethoxyvinyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, MFCD09702441, (E)-1-Ethoxyethene-2-boronic acid pinacol ester, SCHEMBL249656, 2-[(Z)-2-ethoxyethenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, MRAYNLYCQPAZJN-FPLPWBNLSA-N, ZX-AT003648, FCH921768, OR8411, AKOS015949557, ZINC169746038, PS-9758, RP07304, AK-92929, AX8222904, ST24020898, B-5808, [(Z)-2-Ethoxyvinyl]boronic acid, pinacol ester,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	198.143g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	198.069g/mol
Monoisotopic Mass	198.143g/mol
Rotatable Bond Count	3
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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