AG00C0DG

355836-08-7 | 2,4-Dimethyl-6-methoxyphenylboronic acid

AG00C0DG

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CAS Number	355836-08-7
Catalog Number	AG00C0DG(AGN-PC-03HWBM)
Chemical Name	2,4-Dimethyl-6-methoxyphenylboronic acid
IUPAC Name	(2-methoxy-4,6-dimethylphenyl)boronic acid
InChI	InChI=1S/C9H13BO3/c1-6-4-7(2)9(10(11)12)8(5-6)13-3/h4-5,11-12H,1-3H3
InChI Key	UFFAFBPZFGAMJJ-UHFFFAOYSA-N
MDL Number	MFCD04037222
Molecular Formula	C9H13BO3
Molecular Weight	180.0087
SMILES	CC1=C(B(O)O)C(OC)=CC(C)=C1
Synonyms	(2-Methoxy-4,6-dimethylphenyl)boronic acid, 355836-08-7, 2,4-Dimethyl-6-methoxyphenylboronic acid, 2-methoxy-4,6-dimethylphenylboronic acid, SCHEMBL2869340, CTK4H4874, KS-00000MNZ, DTXSID90620276, UFFAFBPZFGAMJJ-UHFFFAOYSA-N, 4442AB, MFCD04037222, AKOS006276745, ZINC169747133, AB17012, DS-6269, AC-16576, AK113433, BC210574, 2,4-dimethyl-6-methoxybenzeneboronic acid, 2-methoxy-4,6-dimethylbenzeneboronic acid, 2-methoxy-4,6-dimethylphenyl boronic acid, 4,6-dimethyl-2-methoxybenzeneboronic acid, ST2414193, 4CH-016164, Boronic acid,B-(2-methoxy-4,6-dimethylphenyl)-, C9H13BO3, (2-Methoxy-4,6-dimethylphenyl)boronicacid, 2,4-DIMETHYL-6-METHOXYPHENYLBORONICACID,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.096g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	180.01g/mol
Monoisotopic Mass	180.096g/mol
Rotatable Bond Count	2
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	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number