AG003HA4

1112208-82-8 | 2-Fluoro-5-formylphenylboronic acid pinacol ester

AG003HA4

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CAS Number	1112208-82-8
Catalog Number	AG003HA4(AGN-PC-0WA6PX)
Chemical Name	2-Fluoro-5-formylphenylboronic acid pinacol ester
IUPAC Name	4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
InChI	InChI=1S/C13H16BFO3/c1-12(2)13(3,4)18-14(17-12)10-7-9(8-16)5-6-11(10)15/h5-8H,1-4H3
InChI Key	WHYMLQVABFAGEK-UHFFFAOYSA-N
MDL Number	MFCD11867877
Molecular Formula	C13H16BFO3
Molecular Weight	250.0737
SMILES	O=CC1=CC=C(F)C(B2OC(C)(C)C(C)(C)O2)=C1
Synonyms	1112208-82-8, 2-Fluoro-5-formylphenylboronic acid pinacol ester, 2-Fluoro-5-formylphenylboronic acid, pinacol ester, 4-Fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde, MFCD11867877, 2-Fluoro-5-formylphenylboronic acid pinacol ester, 95%, (2-FLUORO-5-FORMYLPHENYL)BORONIC ACID PINACOL ESTER, DTXSID30674172, ZXBA000600, AKOS015960321, ZINC169743596, FCH2840595, MB10265, AS-43581, BC000073, PC412419, J3.636.850K, 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolane-2-yl)-4-fluorobenzaldehyde,

Complexity	316
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	250.118g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	250.076g/mol
Monoisotopic Mass	250.118g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number