AG008B59

887757-48-4 | 4-Difluoromethoxyphenylboronic acid pinacol ester

AG008B59

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CAS Number	887757-48-4
Catalog Number	AG008B59(AGN-PC-03JDXF)
Chemical Name	4-Difluoromethoxyphenylboronic acid pinacol ester
IUPAC Name	2-[4-(difluoromethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI	InChI=1S/C13H17BF2O3/c1-12(2)13(3,4)19-14(18-12)9-5-7-10(8-6-9)17-11(15)16/h5-8,11H,1-4H3
InChI Key	BPFSJXBWEVRJFH-UHFFFAOYSA-N
MDL Number	MFCD09878543
Molecular Formula	C13H17BF2O3
Molecular Weight	270.0801
SMILES	CC1(C)OB(OC1(C)C)c1ccc(cc1)OC(F)F
Synonyms	887757-48-4, 2-(4-(Difluoromethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-(Difluoromethoxy)phenylboronic acid pinacol ester, 2-[4-(difluoromethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 4-DIFLUOROMETHOXYPHENYLBORONIC ACID PINACOL ESTER, 2-(4-(difluoromethoxy)phenyl)-4,4,5-trimethyl-1,3,2-dioxaborolane, PubChem19425, SCHEMBL251345, CTK8B3617, DTXSID50621820, BPFSJXBWEVRJFH-UHFFFAOYSA-N, ANW-42826, MFCD09878543, AKOS015999402, ZINC169747385, AB53951, RTR-027943, AK-92847, DS-17696, EN000058, ST2403918, TR-027943, B-3945, (4-(DIFLUOROMETHOXY)PHENYL)BORONIC ACID PINACOL ESTER, 1,3,2-Dioxaborolane,2-[4-(difluoromethoxy)phenyl]-4,4,5,5-tetramethyl-, 2-(4-difluoromethoxyphenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane, difluoromethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl ether, 4-Difluoromethoxyphenylboronicacidpinacolester,

Complexity	299
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	270.124g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	270.083g/mol
Monoisotopic Mass	270.124g/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	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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