AG000YCH

128733-85-7 | 5-t-Butyl-2-methoxyphenylboronic acid

AG000YCH

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CAS Number	128733-85-7
Catalog Number	AG000YCH(AGN-PC-002DXG)
Chemical Name	5-t-Butyl-2-methoxyphenylboronic acid
IUPAC Name	(5-tert-butyl-2-methoxyphenyl)boronic acid
InChI	InChI=1S/C11H17BO3/c1-11(2,3)8-5-6-10(15-4)9(7-8)12(13)14/h5-7,13-14H,1-4H3
InChI Key	LXFOJKCQSAYVMF-UHFFFAOYSA-N
MDL Number	MFCD06201034
Molecular Formula	C11H17BO3
Molecular Weight	208.0619
SMILES	COC1=C(C=C(C=C1)C(C)(C)C)B(O)O
Synonyms	128733-85-7, 5-tert-butyl-2-methoxyphenylboronic acid, (5-(tert-Butyl)-2-methoxyphenyl)boronic acid, 5-TERT-BUTYL-2-METHOXYBENZENEBORONIC ACID, 5-t-Butyl-2-methoxyphenylboronic acid, (5-tert-butyl-2-methoxyphenyl)boronic acid, MFCD06201034, Boronic acid, B-[5-(1,1-dimethylethyl)-2-methoxyphenyl]-, ACMC-1C4ZR, SCHEMBL1506563, 2-Borono-4-(tert-butyl)anisole, CTK4B6040, DTXSID20563485, LXFOJKCQSAYVMF-UHFFFAOYSA-N, ZX-AT013875, ANW-19088, AKOS015837818, ZINC169747047, AB23099, AM90038, OR46511, RTR-004022, 2-Methoxy-5-tert-butylphenylboronic acid, AX8107410, TR-004022, FT-0732916, X0509, B-3732, I14-105556, C11H17BO3, (5-(tert-Butyl)-2-methoxyphenyl)boronicacid, 5-tert-butyl-2-methoxyphenylboronic acid, 95% - 1G 1g,

Complexity	201
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.127g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	208.064g/mol
Monoisotopic Mass	208.127g/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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