Potassium ethenyl(trifluoro)borate(1-)

CAS Number: 13682-77-4
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C=C[B-](F)(F)F.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C2H3BF3
Molecular Weight
94.8508
Drug-likeness
-14.798
CAS
13682-77-4
InChI key
ZCUMGICZWDOJEM-UHFFFAOYSA-N
SMILES
C=C[B-](F)(F)F.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 13682-77-4
Molecule Name Potassium ethenyl(trifluoro)borate(1-)
Molecular Formula K.C2H3BF3
SMILES C=C[B-](F)(F)F.[K+]
InChI InChI=1S/C2H3BF3.K/c1-2-3(4,5)6;/h2H,1H2;/q-1;+1
InChI Key ZCUMGICZWDOJEM-UHFFFAOYSA-N
CanonicalSyTyLFy 1f5fec60dcc91b62
TotalMolweight 133.949
Molecular Weight 94.8508
MonoisotopicMass 95.027989
CLogP 0.4292
CLogS -0.81
TotalSurfaceArea 70.63
Drug-likeness -14.798
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.66667
Molecula Flexibility 0.73779
Molecular Complexity 0.89588
Fragments 2
Non HAtoms 6
NonCHAtoms 4
Electronegative Atoms 3
Rotatable Bond 1
Symmetricatoms 2

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