AG003JPY

1426245-63-7 | (3-Methyl-4-morpholinophenyl)boronic acid

AG003JPY

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CAS Number	1426245-63-7
Catalog Number	AG003JPY(AGN-PC-0BLD4X)
Chemical Name	(3-Methyl-4-morpholinophenyl)boronic acid
IUPAC Name	(3-methyl-4-morpholin-4-ylphenyl)boronic acid
InChI	InChI=1S/C11H16BNO3/c1-9-8-10(12(14)15)2-3-11(9)13-4-6-16-7-5-13/h2-3,8,14-15H,4-7H2,1H3
InChI Key	SPIHCTVLDYDVCE-UHFFFAOYSA-N
MDL Number	MFCD16495874
Molecular Formula	C11H16BNO3
Molecular Weight	221.0606
SMILES	CC1=CC(B(O)O)=CC=C1N2CCOCC2
Synonyms	3-METHYL-4-MORPHOLINOPHENYLBORONIC ACID, 1426245-63-7, (3-methyl-4-morpholinophenyl)boronic acid, 3-Methyl-4-morpholinophenylboronicAcid, AK174206, SCHEMBL12595753, KS-00000APZ, SPIHCTVLDYDVCE-UHFFFAOYSA-N, 5915AJ, MFCD16495874, AKOS024256607, ZINC170002760, DS-8673, TRA0062344, SY008002, AB0053596, TC-307464, CS-0061269, FT-0710269, Z-4413, [3-methyl-4-(4-morpholinyl)phenyl]boronic Acid, MFCD16495874 (97+%), C11H16BNO3, B-[3-methyl-4-(4-morpholinyl)phenyl]Boronic acid, N/A, 15115-60-3,

Complexity	221
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.122g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	221.063g/mol
Monoisotopic Mass	221.122g/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
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number