Potassium Benzo[d][1,3]dioxol-5-yltrifluoroborate
Product Information
Molecular Formula
C7H5F3O2BK
Molecular Weight
228.02
Description
Potassium Benzo[d][1,3]dioxol-5-yltrifluoroborate (CAS# 871231-46-8) is a useful research chemical compound.
Synonyms
potassium;1,3-benzodioxol-5-yl(trifluoro)boranuide; potassium;1,3-benzodioxol-5-yl(trifluoro)boranuide
IUPAC Name
potassium;1,3-benzodioxol-5-yl(trifluoro)boranuide
SMILES
[B-](C1=CC2=C(C=C1)OCO2)(F)(F)F.[K+]
InChI
InChI=1S/C7H5BF3O2.K/c9-8(10,11)5-1-2-6-7(3-5)13-4-12-6;/h1-3H,4H2;/q-1;+1
InChI Key
DGKKZZSEXSGSIG-UHFFFAOYSA-N
Melting Point
236-242 °C
Purity
97 %
Appearance
Solid
LogP
1.46970
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
6
Rotatable Bond Count
0
Exact Mass
227.9971755 g/mol
Monoisotopic Mass
227.9971755 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
202
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 |
|---|---|---|
| KR-101492961-B1 | Justicidin a derivatives of arylnaphthalene lignan structure and method for producing the same | 2013-01-31 |
| KR-20140098466-A | Justicidin a derivatives of arylnaphthalene lignan structure and method for producing the same | 2013-01-31 |
| US-2015336938-A1 | Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure | 2013-01-31 |
| US-9650355-B2 | Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure | 2013-01-31 |
| WO-2014119892-A1 | Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure | 2013-01-31 |
| AU-2013340896-A1 | Pressure process | 2012-10-31 |
| AU-2013340896-A2 | Pressure process | 2012-10-31 |
| AU-2013340896-B2 | Pressure process | 2012-10-31 |
| EP-2914563-A1 | Pressure process | 2012-10-31 |
| JP-2016500645-A | Printing method | 2012-10-31 |
