Potassium trifluoro(trifluoromethyl)borate(1-)

CAS Number: 42298-15-7
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F[B-](C(F)(F)F)(F)F.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.CBF6
Molecular Weight
136.81
Drug-likeness
-17.748
CAS
42298-15-7
InChI key
UOGBGCVSVMQVBR-UHFFFAOYSA-N
SMILES
F[B-](C(F)(F)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 42298-15-7
Molecule Name Potassium trifluoro(trifluoromethyl)borate(1-)
Molecular Formula K.CBF6
SMILES F[B-](C(F)(F)F)(F)F.[K+]
InChI InChI=1S/CBF6.K/c3-1(4,5)2(6,7)8;/q-1;+1
InChI Key UOGBGCVSVMQVBR-UHFFFAOYSA-N
CanonicalSyTyLFy 46ad31d6227c9c6c
TotalMolweight 175.908
Molecular Weight 136.81
MonoisotopicMass 136.999723
CLogP 1.8786
CLogS -1.958
TotalSurfaceArea 75.55
Drug-likeness -17.748
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.5
Molecula Flexibility 0.73469
Molecular Complexity 0.69315
Fragments 2
Non HAtoms 8
NonCHAtoms 7
Electronegative Atoms 6
Rotatable Bond 1
Sp3Atoms 1
Symmetricatoms 4

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