Magnesium potassium phosphate (1/1/1)

CAS Number: 13718-30-4
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[O-]P([O-])([O-])=O.[Mg+2].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.O4P.Mg
Molecular Weight
94.97
Drug-likeness
-14.318
CAS
13718-30-4
InChI key
YQRTZUSEPDULET-UHFFFAOYSA-K
SMILES
[O-]P([O-])([O-])=O.[Mg+2].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 13718-30-4
Molecule Name Magnesium potassium phosphate (1/1/1)
Molecular Formula K.O4P.Mg
SMILES [O-]P([O-])([O-])=O.[Mg+2].[K+]
InChI InChI=1S/K.Mg.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q+1;+2;/p-3
InChI Key YQRTZUSEPDULET-UHFFFAOYSA-K
CanonicalSyTyLFy d9645b270af7ad2d
TotalMolweight 158.373
Molecular Weight 94.97
MonoisotopicMass 94.953422
CLogP -8.7821
CLogS 1.958
H Acceptors 4
TotalSurfaceArea 59.86
Relative PSA 1
PolarSurfaceArea 96.06
Drug-likeness -14.318
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecular Complexity 0.54931
Fragments 3
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 4
Symmetricatoms 2
AcidicOxygens 3

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