AG001XYI

168267-41-2 | Boronic acid, B-(3,4-difluorophenyl)-

AG001XYI

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CAS Number	168267-41-2
Catalog Number	AG001XYI(AGN-PC-0KK6IA)
Chemical Name	Boronic acid, B-(3,4-difluorophenyl)-
IUPAC Name	(3,4-difluorophenyl)boronic acid
InChI	InChI=1S/C6H5BF2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,10-11H
InChI Key	RMGYQBHKEWWTOY-UHFFFAOYSA-N
MDL Number	MFCD00807405
Molecular Formula	C6H5BF2O2
Molecular Weight	157.9105
SMILES	Fc1ccc(cc1(F))B(O)O
Synonyms	3,4-Difluorophenylboronic acid, 168267-41-2, (3,4-difluorophenyl)boronic acid, 3,4-Difluorobenzeneboronic acid, (3,4-Difluorophenyl)Boranediol, 3,4-difluorophenylbornic acid, 3,4-fluorobenzene boronic acid, 3,4-difluoro phenylboronic acid, 3,4-difluorophenyl boronic acid, MFCD00807405, 3,4-Difluorophenylboronicacid, 3,4-difluoro phenylboric acid, 3,4-difluorobenzenebornoic acid, BORONIC ACID, (3,4-DIFLUOROPHENYL)-, BORONIC ACID, B-(3,4-DIFLUOROPHENYL)-, 3,4-Difluorophenylboronic acid, 97%, PubChem1821, ACMC-209dxw, AC1MC0W8, KSC174Q3B, 3,4-difluorphenylboronic acid, AKOS BRN-0090, SCHEMBL128893, 3,4-diflurophenyl boronic acid, AC1Q714P, 3,4-di-fluorophenylboronic acid, 3,4-difluoro-phenylboronic acid, CTK0H4830, KS-00000APW, 3,4-difluoro-benzeneboronic acid, 3,4-difluorobenzene boronic acid, DTXSID30370228, RMGYQBHKEWWTOY-UHFFFAOYSA-N, ALBB-006122, BCP22748, CS-D1003, dihydroxy(3,4-difluorophenyl)borane, ANW-22338, CD-272, SBB048075, STK009924, B-(3,4-difluorophenyl)-boronic acid, AKOS000264712, ZINC169743241, AB07331, AC-5381, AS04988, BCP9000262, D2680G1, GS-6748, LS10945, RL02155, RP02003, RTC-068718, TRA0034716, XF10005, [3,4-bis(fluoranyl)phenyl]boronic acid, AK-33624, AN-11079, BC000732, BP-10722, BR-33624, SY007939, AB0010808, AB1003223, DB-028255, ST2410258, TC-068718, TL8001301, AM20060169, D3350, FT-0084857, FT-0614277, A-1725, MFCD00807405 (97+%), 267D412, A810954, I01-1699, Q-102207, 3,4-Difluorophenylboronic Acid (contains varying a mounts of Anhydride), C6H5BF2O2, ACN-029098, CID2734337, Boronic acid, (3,4-difluorophenyl)- (9CI), 3,4-Difluorophenylboronic acid, 98% - 1G 1g, 1849-55-4,

Complexity	134
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.035g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	157.911g/mol
Monoisotopic Mass	158.035g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302+H312+H332-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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