AG00GA5T

845457-55-8 | (3-Methylbenzofuran-2-yl)boronic acid

AG00GA5T

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CAS Number	845457-55-8
Catalog Number	AG00GA5T(AGN-PC-07Y6AP)
Chemical Name	(3-Methylbenzofuran-2-yl)boronic acid
IUPAC Name	(3-methyl-1-benzofuran-2-yl)boronic acid
InChI	InChI=1S/C9H9BO3/c1-6-7-4-2-3-5-8(7)13-9(6)10(11)12/h2-5,11-12H,1H3
InChI Key	KXPBYTSLFQFSCG-UHFFFAOYSA-N
MDL Number	MFCD18383018
Molecular Formula	C9H9BO3
Molecular Weight	175.9770
SMILES	CC1=C(B(O)O)OC2=CC=CC=C12
Synonyms	(3-Methylbenzofuran-2-yl)boronic acid, 845457-55-8, AK158882, MFCD18383018, AKOS015968028, ZINC169747526, DS-9411, FCH1174989, AX8292474, ST2402343,

Complexity	186
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.064g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	175.978g/mol
Monoisotopic Mass	176.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	53.6A^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

Lot Number