AG00G3DB

850623-38-0 | Potassium (4-carboxyphenyl)trifluoroborate

AG00G3DB

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CAS Number	850623-38-0
Catalog Number	AG00G3DB(AGN-PC-0UX3SN)
Chemical Name	Potassium (4-carboxyphenyl)trifluoroborate
IUPAC Name	potassium;(4-carboxyphenyl)-trifluoroboranuide
InChI	InChI=1S/C7H5BF3O2.K/c9-8(10,11)6-3-1-5(2-4-6)7(12)13;/h1-4H,(H,12,13);/q-1;+1
InChI Key	NMZCPMQLYMSRAD-UHFFFAOYSA-N
MDL Number	MFCD04115737
Molecular Formula	C7H5BF3KO2
Molecular Weight	228.0179
SMILES	F[B-](F)(C1=CC=C(C(O)=O)C=C1)F.[K+]
Synonyms	850623-38-0, Potassium (4-carboxyphenyl)trifluoroborate, Potassium 4-carboxyphenyltrifluoroborate, MFCD04115737, POTASSIUM (4-CARBOXYPHENYL)TRIFLUOROBORANUIDE, PubChem11378, AMTB110, SCHEMBL3951402, DTXSID50635705, KS-000022AD, ZX-AP006569, SBB097223, AKOS015910156, AB20502, AS-2344, FCH1322245, PC11245, AX8148674, ST24048965, potassium (4-carboxyphenyl)-trifluoroboranuide, B-5046, potassium ion (4-carboxyphenyl)trifluoroboranuide, A841155, Potassium (4-carboxyphenyl)(trifluoro)borate(1-), potassium (4-carboxyphenyl)-tris(fluoranyl)boranuide, I14-31109, C7H5BF3KO2, ACN-042835, CID2782890, Potassium (4-carboxyphenyl)-trifluoro-boron,

Complexity	202
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.997g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	228.019g/mol
Monoisotopic Mass	227.997g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^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

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