AG001LE0

149104-90-5 | Boronic acid, B-(4-acetylphenyl)-

AG001LE0

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CAS Number	149104-90-5
Catalog Number	AG001LE0(AGN-PC-0KYUTC)
Chemical Name	Boronic acid, B-(4-acetylphenyl)-
IUPAC Name	(4-acetylphenyl)boronic acid
InChI	InChI=1S/C8H9BO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5,11-12H,1H3
InChI Key	OBQRODBYVNIZJU-UHFFFAOYSA-N
MDL Number	MFCD01074667
Molecular Formula	C8H9BO3
Molecular Weight	163.9663
SMILES	OB(C1=CC=C(C(C)=O)C=C1)O
Synonyms	4-Acetylphenylboronic acid, 149104-90-5, (4-acetylphenyl)boronic Acid, 4-Acetylbenzeneboronic Acid, p-acetylphenylboronic acid, 4-acetylphenyl boronic acid, 1-[4-(Dihydroxyboranyl)Phenyl]Ethan-1-One, 4-Acetylphenylboronic acid, 97%, Boronic acid, B-(4-acetylphenyl)-, MFCD01074667, BORONIC ACID, (4-ACETYLPHENYL)-, 4acetylphenylboronic acid, 4-actylphenylboronic acid, AC1Q1JNQ, 4acetylbenzeneboronic acid, p-acetylbenzeneboronic acid, 4-acetyl-phenylboronic acid, AC1MV4M3, SCHEMBL9416, 4-acetylbenzene boronic acid, 4-(acetyl)phenylboronic acid, 4-acetyl phenyl boronic acid, 4-acetyl-phenyl boronic acid, AMTB944, KSC174K1H, 4-acetyl benzene boronic acid, 4-(acetyl)phenyl boronic acid, (4-Acetyl)-phenylboronic acid, ACMC-1C239, CHEMBL1209760, CTK0H4513, DTXSID90395250, OBQRODBYVNIZJU-UHFFFAOYSA-N, BM256, Boronicacid, B-(4-acetylphenyl)-, ACT10934, CS-D1037, KS-000000YD, ANW-21182, BBL100447, CA-599, SBB000146, STL554241, AKOS004116069, ZINC169743314, AB08109, AS-3014, LS10863, RP02334, RTR-035758, TRA0002055, VB10667, NCGC00249503-01, AK-45484, AM808105, SC-01236, SY014779, AB0005223, AB1003867, DB-009534, ST2405509, TL8001069, TR-035758, 4CH-001180, FT-0084898, FT-0617405, A-3662, 14368-EP2316836A1, 41391-EP2272817A1, 41391-EP2280010A2, 41391-EP2287141A1, 41391-EP2311831A1, MFCD01074667 (97+%), 047A291, 4-Acetylbenzeneboronic acid; 4'-Boronoacetophenone, I01-3197, J-501346, 4-Acetylphenylboronicacid, C8H9BO3, ACN-029141, CID3702122, Boronic acid, (4-acetylphenyl)- (9CI), 4-Acetylphenylboronic acid, 98% - 1G 1g, A1907, 4-Acetylphenylboronic acid, 98% - 25G 25g, 14047-29-1,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.064g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	163.967g/mol
Monoisotopic Mass	164.064g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	57.5A^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