AG001WP0

166386-48-7 | 4-Methylsulfinylphenylboronic acid

AG001WP0

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CAS Number	166386-48-7
Catalog Number	AG001WP0(AGN-PC-0KKVI5)
Chemical Name	4-Methylsulfinylphenylboronic acid
IUPAC Name	(4-methylsulfinylphenyl)boronic acid
InChI	InChI=1S/C7H9BO3S/c1-12(11)7-4-2-6(3-5-7)8(9)10/h2-5,9-10H,1H3
InChI Key	YOTGALZTDVXUKZ-UHFFFAOYSA-N
MDL Number	MFCD02093071
Molecular Formula	C7H9BO3S
Molecular Weight	184.0206
SMILES	CS(=O)C1=CC=C(C=C1)B(O)O
Synonyms	166386-48-7, (4-(Methylsulfinyl)phenyl)boronic acid, 4-(Methanesulfinyl)benzeneboronic acid, 4-(Methylsulphinyl)benzeneboronic acid, (4-methylsulfinylphenyl)boronic Acid, 4-(methylsulfinyl)phenylboronic acid, 4-(Methylsulfinylphenyl)boronic acid, Boronic acid, [4-(methylsulfinyl)phenyl]-, 4-Methylsulfinylphenylboronic acid, 4-Methanesulphinylphenylboronic acid, MFCD02093071, [4-(methylsulfinyl)phenyl]boronic acid, akos brn-0326, ACMC-209du9, AC1MCN33, 4-Boronophenylmethylsulfoxide, SCHEMBL387447, CTK8B0949, DTXSID60378530, YOTGALZTDVXUKZ-UHFFFAOYSA-N, 4 - Boronophenyl methyl sulfoxide, 4-methanesulfinylphenylboronic acid, ZX-AT021082, 4-(Methylsulfinylpheny)lboronic acid, 4-Methylsulfinylbenzene boronic acid, (4-methanesulfinylphenyl)boronic acid, ANW-22207, FCH918245, 4-(methylsulfinyl)phenyl boronic acid, 4-Methylsulfinyl benzene boronic acid, AKOS004116476, AB10761, M4480G1, MCULE-8463190272, OR10559, RP09132, RTC-069206, [4-(Methanesulfinyl)phenyl]boronic acid, [4-(Methylsulphinyl)phenyl]boronic acid, SC-91014, AX8018769, DB-010631, TC-069206, TL8001279, FT-0616797, Boronic acid, B-[4-(methylsulfinyl)phenyl]-, (+/-)-[4-(methylsulfinyl)phenyl]boronic acid, B-2436, 4-(Methylsulfinyl)phenylboronic acid, AldrichCPR, J-513771, I14-35524, 4-boronophenyl methyl sulphoxide~4-(methylsulphinyl)phenylboronic acid, 4-Boronophenyl methyl sulfoxide, 4-(Methylsulfonyl)phenylboronic acid, CID2773531, 4-(METHYLSULFINYL)BENZENEBORONIC ACID, 4-(METHYLSULPHINYL)PHENYLBORONIC ACID, 4-(METHANESULPHINYL)BENZENEBORONIC ACID,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.037g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	184.016g/mol
Monoisotopic Mass	184.037g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	76.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
UN Code

Certificate of Analysis

Lot Number