AG0074E4

126617-98-9 | (2-(Methoxymethyl)phenyl)boronic acid

AG0074E4

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CAS Number	126617-98-9
Catalog Number	AG0074E4(AGN-PC-0KZNVG)
Chemical Name	(2-(Methoxymethyl)phenyl)boronic acid
IUPAC Name	[2-(methoxymethyl)phenyl]boronic acid
InChI	InChI=1S/C8H11BO3/c1-12-6-7-4-2-3-5-8(7)9(10)11/h2-5,10-11H,6H2,1H3
InChI Key	JHPPAFXQJZJGEP-UHFFFAOYSA-N
MDL Number	MFCD03412110
Molecular Formula	C8H11BO3
Molecular Weight	165.9821
SMILES	C1=C(C(=CC=C1)COC)B(O)O
Synonyms	126617-98-9, 2-Methoxymethylphenylboronic acid, (2-(METHOXYMETHYL)PHENYL)BORONIC ACID, 2-Methoxymethylbenzeneboronic acid, 2-(Methoxymethyl)phenylboronic acid, [2-(methoxymethyl)phenyl]boronic Acid, 2-(Methoxymethyl)benzeneboronic acid, 2-Methoxymethylphebylboronic acid, 2-Methoxymethyl phenylboronic acid, MFCD03412110, Boronic acid, [2-(methoxymethyl)phenyl]-, 2-(Methoxymethyl)phenylboronic acid, 98%, PubChem7997, ACMC-209bbg, AC1MX3L2, SCHEMBL520432, 2-MethoxymethylbenzeneboronicAcid, CTK3J3933, KS-00000APN, DTXSID00396031, 2-methoxymethyl-phenylboronic acid, JHPPAFXQJZJGEP-UHFFFAOYSA-N, (2-methoxymethylphenyl)boronic acid, 2-(Methoxymethyl)phenyl-boronic acid, ANW-18938, AKOS004116556, ZINC169743676, AB14377, CS-W003051, M4180G1, PS-9419, RP02447, RTR-003875, TRA0054278, VB10564, AK-46523, AN-32516, BC001950, BR-46523, N901, SC-00678, SY004013, AB0016126, AB1000006, ST2407865, TR-003875, 4CH-001303, AM20020352, FT-0605398, 2-methoxymethylphenylboronic acid, AldrichCPR, MFCD03412110 (97%), [2-(METHOXYMETHYL)PHENYL]-BORONIC ACID, A21954, B-3361, 617M989, I04-5102, J-500527, null, C8H11BO3, ACN-044065, CID3759408,

Complexity	130
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.08g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	165.983g/mol
Monoisotopic Mass	166.08g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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