Potassium perfluoropropanoate

CAS Number: 378-76-7
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[O-]C(C(C(F)(F)F)(F)F)=O.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C3O2F5
Molecular Weight
163.021
Drug-likeness
-64.321
CAS
378-76-7
InChI key
AHGFDQXBCIASJK-UHFFFAOYSA-M
SMILES
[O-]C(C(C(F)(F)F)(F)F)=O.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 378-76-7
Molecule Name Potassium perfluoropropanoate
Molecular Formula K.C3O2F5
SMILES [O-]C(C(C(F)(F)F)(F)F)=O.[K+]
InChI InChI=1S/C3HF5O2.K/c4-2(5,1(9)10)3(6,7)8;/h(H,9,10);/q;+1/p-1
InChI Key AHGFDQXBCIASJK-UHFFFAOYSA-M
CanonicalSyTyLFy b9f5f6a870d080ec
TotalMolweight 202.119
Molecular Weight 163.021
MonoisotopicMass 162.981845
CLogP -1.1818
CLogS -1.917
H Acceptors 2
TotalSurfaceArea 91.35
Relative PSA 0.29907
PolarSurfaceArea 40.13
Drug-likeness -64.321
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.5
Molecula Flexibility 0.82455
Molecular Complexity 0.79451
Fragments 2
Non HAtoms 10
NonCHAtoms 7
Electronegative Atoms 7
Rotatable Bond 2
Sp3Atoms 3
Symmetricatoms 3
AcidicOxygens 1

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