AG0004O0

1015082-78-6 | Potassium 4-(hydroxymethyl)phenyltrifluoroborate

AG0004O0

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CAS Number	1015082-78-6
Catalog Number	AG0004O0(AGN-PC-0WAY0V)
Chemical Name	Potassium 4-(hydroxymethyl)phenyltrifluoroborate
IUPAC Name	potassium;trifluoro-[4-(hydroxymethyl)phenyl]boranuide
InChI	InChI=1S/C7H7BF3O.K/c9-8(10,11)7-3-1-6(5-12)2-4-7;/h1-4,12H,5H2;/q-1;+1
InChI Key	HQOSFYRRFPFWTG-UHFFFAOYSA-N
MDL Number	MFCD08276800
Molecular Formula	C7H7BF3KO
Molecular Weight	214.0344
SMILES	OCC1=CC=C([B-](F)(F)F)C=C1.[K+]
Synonyms	1015082-78-6, Potassium 4-(hydroxymethyl)phenyltrifluoroborate, MFCD08276800, Potassium (4-hydroxymethylphenyl)ltrifluoroborate, Potassium trifluoro(4-(hydroxymethyl)phenyl)borate, potassium trifluoro[4-(hydroxymethyl)phenyl]boranuide, PubChem11367, AMTB228, SCHEMBL909654, DTXSID60635711, ZX-RL002734, AKOS016339812, AS-2430, FCH1325792, KS-000022C3, PC200164, AB0008931, M-2044, Potassium (4-hydroxymethyl phenyl)ltrifluoroborate, Potassium 4-(hydroxymethyl)phenyltrifluoroborate, 97%, Potassium trifluoro[4-(hydroxymethyl)phenyl]borate(1-), Borate(1-), trifluoro[4-(hydroxymethyl)phenyl]-, potassium (1:1), (T-4)-, C7H7BF3KO,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.018g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	214.036g/mol
Monoisotopic Mass	214.018g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^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