Potassium Benzyltrifluoroborate
Product Information
Molecular Formula
C7H7F3BK
Molecular Weight
198.03
Description
Organotrifluoroborate involved in: Oxidation; Ritter-type amidation with nitriles; Photo-allylation / photo-benzylation of carbonyl compounds; Stereoselective nucleophilic addition; Suzuki cross-couplingOrganotrifluoroborates as versatile and stable boronic acid surrogates.
Synonyms
potassium;trifluoro-(phenylmethyl)boranuide; potassium;benzyl(trifluoro)boranuide
IUPAC Name
potassium;benzyl(trifluoro)boranuide
SMILES
[B-](CC1=CC=CC=C1)(F)(F)F.[K+]
InChI
InChI=1S/C7H7BF3.K/c9-8(10,11)6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1
InChI Key
WGHDAVWURFVTQC-UHFFFAOYSA-N
Melting Point
>300 °C (lit.)
Flash Point
Not applicable
Purity
95 %
LogP
2.88210
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
198.0229964 g/mol
Monoisotopic Mass
198.0229964 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
120
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| US-2021094951-A1 | Inhibitors of receptor interacting protein kinase i for the treatment of disease | 2019-09-06 |
| WO-2021046515-A1 | Inhibitors of receptor interacting protein kinase i for the treatment of disease | 2019-09-06 |
| CN-110294776-B | Method for preparing aryl phosphine oxide derivative | 2019-06-20 |
| CN-111592563-A | Compound containing carbon-silicon bond and application thereof | 2019-02-21 |
| BR-112020025605-A2 | pyrazole and imidazole compounds for inhibition of il-17 and rorgama | 2018-06-15 |
| CA-3103726-A1 | Pyrazole and imidazole compounds for inhibition of il-17 and rorgamma | 2018-06-15 |
| CN-112654610-A | Pyrazole and imidazole compounds for inhibiting IL-17 and ROR gamma | 2018-06-15 |
| KR-20210032936-A | Pyrazole and imidazole compounds for inhibition of IL-17 and ROR gamma | 2018-06-15 |
| JP-2021527650-A | Pyrazole and imidazole compounds for inhibition of IL-17 and RORγ | 2018-06-15 |
| US-2021292281-A1 | Pyrazole and imidazole compounds for inhibition of il-17 and rorgamma | 2018-06-15 |
