Potassium ethyl(trifluoro)borate(1-)

CAS Number: 44248-07-9
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CC[B-](F)(F)F.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C2H5BF3
Molecular Weight
96.8667
Drug-likeness
-13.39
CAS
44248-07-9
InChI key
GIIPADVFWNGSKY-UHFFFAOYSA-N
SMILES
CC[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 44248-07-9
Molecule Name Potassium ethyl(trifluoro)borate(1-)
Molecular Formula K.C2H5BF3
SMILES CC[B-](F)(F)F.[K+]
InChI InChI=1S/C2H5BF3.K/c1-2-3(4,5)6;/h2H2,1H3;/q-1;+1
InChI Key GIIPADVFWNGSKY-UHFFFAOYSA-N
CanonicalSyTyLFy b5d87442a1270756
TotalMolweight 135.965
Molecular Weight 96.8667
MonoisotopicMass 97.043639
CLogP 0.9483
CLogS -3.011
TotalSurfaceArea 72.11
Drug-likeness -13.39
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.66667
Molecula Flexibility 0.68141
Molecular Complexity 0.89588
Fragments 2
Non HAtoms 6
NonCHAtoms 4
Electronegative Atoms 3
Rotatable Bond 1
Sp3Atoms 2
Symmetricatoms 2

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