AG002R1S

259209-22-8 | Boronic acid, B-(2-hydroxy-3-methylphenyl)-

AG002R1S

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CAS Number	259209-22-8
Catalog Number	AG002R1S(AGN-PC-01YWS3)
Chemical Name	Boronic acid, B-(2-hydroxy-3-methylphenyl)-
IUPAC Name	(2-hydroxy-3-methylphenyl)boronic acid
InChI	InChI=1S/C7H9BO3/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4,9-11H,1H3
InChI Key	UQMOSSMYPIJNTO-UHFFFAOYSA-N
MDL Number	MFCD08689549
Molecular Formula	C7H9BO3
Molecular Weight	151.9556
SMILES	CC1=CC=CC(B(O)O)=C1O
Synonyms	259209-22-8, 2-Hydroxy-3-methylphenylboronic acid, (2-Hydroxy-3-methylphenyl)boronic acid, BORONIC ACID, B-(2-HYDROXY-3-METHYLPHENYL)-, 2-Hydroxy-3-methyl phenyl boronic acid, ACMC-1CH54, SCHEMBL1684421, CTK4F6743, DTXSID10595154, UQMOSSMYPIJNTO-UHFFFAOYSA-N, 2-(Dihydroxyboryl)-6-methylphenol, ANW-25846, FCH862405, MFCD08689549, AKOS006289758, ZINC169794560, AB48273, RTR-011757, 2-hydroxy-3-methyl-phenyl boronic acid, ACM259209228, OR361259, SC-52698, AX8008090, TR-011757, FT-0690297, X0658, C-1937, 2-hydroxy-3-methylphenyl boronic acid, AldrichCPR, Boronic acid,(2-hydroxy-3-methylphenyl)- (9CI), I04-2968, C7H9BO3, (2-Hydroxy-3-methylphenyl)boronicacid, 2-hydroxy-3-(1H-indol-3-yl)butanoic acid,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	152.064g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	151.956g/mol
Monoisotopic Mass	152.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	60.7A^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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