Dipotassium phosphorofluoridate

CAS Number: 14104-28-0
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[O-]P([O-])(F)=O.[K+].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.K.O3FP
Molecular Weight
97.969
Drug-likeness
-10.098
CAS
14104-28-0
InChI key
FXNRKXSSLJKNGH-UHFFFAOYSA-L
SMILES
[O-]P([O-])(F)=O.[K+].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 14104-28-0
Molecule Name Dipotassium phosphorofluoridate
Molecular Formula K.K.O3FP
SMILES [O-]P([O-])(F)=O.[K+].[K+]
InChI InChI=1S/FH2O3P.2K/c1-5(2,3)4;;/h(H2,2,3,4);;/q;2*+1/p-2
InChI Key FXNRKXSSLJKNGH-UHFFFAOYSA-L
CanonicalSyTyLFy 43c7dee7e1d0f47
TotalMolweight 176.165
Molecular Weight 97.969
MonoisotopicMass 97.95691
CLogP -5.2275
CLogS 2.149
H Acceptors 3
TotalSurfaceArea 58.68
Relative PSA 0.77676
PolarSurfaceArea 73
Drug-likeness -10.098
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions acyl-halogenide type
Shape Index 0.6
Molecular Complexity 0.69315
Fragments 3
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 3
Symmetricatoms 1
AcidicOxygens 2

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