AG00BCUB

240139-82-6 | 2-Methoxy-5-trifluoromethylphenylboronic acid

AG00BCUB

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CAS Number	240139-82-6
Catalog Number	AG00BCUB(AGN-PC-0KL1TG)
Chemical Name	2-Methoxy-5-trifluoromethylphenylboronic acid
IUPAC Name	[2-methoxy-5-(trifluoromethyl)phenyl]boronic acid
InChI	InChI=1S/C8H8BF3O3/c1-15-7-3-2-5(8(10,11)12)4-6(7)9(13)14/h2-4,13-14H,1H3
InChI Key	PXDQUMRSSQYJSX-UHFFFAOYSA-N
MDL Number	MFCD04039222
Molecular Formula	C8H8BF3O3
Molecular Weight	219.9535
SMILES	OB(C1=CC(C(F)(F)F)=CC=C1OC)O
Synonyms	240139-82-6, 2-METHOXY-5-(TRIFLUOROMETHYL)PHENYLBORONIC ACID, 2-METHOXY-5-TRIFLUOROMETHYLPHENYLBORONIC ACID, 2-Methoxy-5-(trifluoromethyl)benzeneboronic acid, (2-Methoxy-5-trifluoromethylphenyl)boronic acid, [2-methoxy-5-(trifluoromethyl)phenyl]boronic Acid, 5-(TRIFLUOROMETHYL)-2-METHOXYPHENYLBORONIC ACID, (2-Methoxy-5-(trifluoromethyl)phenyl)boronic acid, MFCD04039222, Boronic acid,B-[2-methoxy-5-(trifluoromethyl)phenyl]-, ACMC-209g7u, AC1MD2U1, SCHEMBL319585, CTK4F2757, DTXSID50382207, PXDQUMRSSQYJSX-UHFFFAOYSA-N, 3-Borono-4-methoxybenzotrifluoride, ZX-AP001185, ANW-25288, CM-909, SBB052533, AKOS004116395, ZINC169745621, AB17317, CS-W014758, PC11116, RL02762, RP05131, RTR-011110, VB10346, AK-42251, AS-17803, BC001176, CC-00400, SC-49754, AB0020865, AX8011096, DB-010461, TR-011110, FT-0084849, FT-0644089, ST24040773, V1887, 2-methoxy-5-trifluoromethyl-phenylboronic acid, 2-methoxy-5-trifluoromethylbenzeneboronic acid, 2-methoxy-5-trifluoromethyl-phenyl-boronic acid, C-1539, 2-methoxy-5-(trifluoromethyl)-phenylboronic acid, 139M826, A817038, C-12102, [2-methoxy-5-(trifluoromethyl)phenyl] boronic acid, I01-3488, J-516443, [2-(Methyloxy)-5-(trifluoromethyl)phenyl]boronic acid, 2-Methoxy-5-trifluoromethylphenylboronic acid, AldrichCPR, B-[2-METHOXY-5-(TRIFLUOROMETHYL)PHENYL]-BORONIC ACID, BORONIC ACID, B-[2-METHOXY-5-(TRIFLUOROMETHYL)PHENYL]-, C8H8BF3O3, ACN-034262, CID2782676, (2-Methoxy-5-(trifluoromethyl)phenyl)boronicacid, 2-METHOXY-5-TRIFLUOROMETHYLPHENYLBORONICACID,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.052g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	219.954g/mol
Monoisotopic Mass	220.052g/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	H315-H319-H335
Packing Group
Precautionary statements	P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number