AG0015RT

1217500-95-2 | Boronic acid, B-[3-fluoro-5-(4-morpholinyl)phenyl]-

AG0015RT

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CAS Number	1217500-95-2
Catalog Number	AG0015RT(AGN-PC-0WA8NE)
Chemical Name	Boronic acid, B-[3-fluoro-5-(4-morpholinyl)phenyl]-
IUPAC Name	(3-fluoro-5-morpholin-4-ylphenyl)boronic acid
InChI	InChI=1S/C10H13BFNO3/c12-9-5-8(11(14)15)6-10(7-9)13-1-3-16-4-2-13/h5-7,14-15H,1-4H2
InChI Key	LZZMZSFQBPERPZ-UHFFFAOYSA-N
MDL Number	MFCD12546541
Molecular Formula	C10H13BFNO3
Molecular Weight	225.0245
SMILES	FC1=CC(B(O)O)=CC(N2CCOCC2)=C1
Synonyms	1217500-95-2, (3-Fluoro-5-morpholinophenyl)boronic acid, 3-Fluoro-5-morpholinophenylboronic acid, AK-93613, ACMC-209ag6, CTK4B2665, DTXSID30675220, ANW-17812, MFCD12546541, AKOS015853136, ZINC169746539, AM86403, KS-00000Q13, DS-17863, PC412143, AX8230995, TR-034685, 4CH-004379, ST24020410, Z8463, [3-Fluoro-5-(morpholin-4-yl)phenyl]boronic acid, I04-2854, Boronic acid, B-[3-fluoro-5-(4-morpholinyl)phenyl]-, C10H13BFNO3, (3-Fluoro-5-morpholinophenyl)boronicacid, A-5540,

Complexity	226
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.097g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	225.026g/mol
Monoisotopic Mass	225.097g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.9A^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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