Dipotassium hydrogenorthophosphate

CAS Number: 11-4-7758
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[O-]P([O-])(O)=O.[K+].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.K.HO4P
Molecular Weight
95.9779
Drug-likeness
-14.758
CAS
11-4-7758
InChI key
ZPWVASYFFYYZEW-UHFFFAOYSA-L
SMILES
[O-]P([O-])(O)=O.[K+].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 11-4-7758
Molecule Name Dipotassium hydrogenorthophosphate
Molecular Formula K.K.HO4P
SMILES [O-]P([O-])(O)=O.[K+].[K+]
InChI InChI=1S/2K.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q2*+1;/p-2
InChI Key ZPWVASYFFYYZEW-UHFFFAOYSA-L
CanonicalSyTyLFy d9645b270af7ad2d
TotalMolweight 174.174
Molecular Weight 95.9779
MonoisotopicMass 95.961247
CLogP -7.5345
CLogS 1.958
H Acceptors 4
H Donors 1
TotalSurfaceArea 58.68
Relative PSA 1
PolarSurfaceArea 93.23
Drug-likeness -14.758
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecular Complexity 0.69315
Fragments 3
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 4
Symmetricatoms 1
AcidicOxygens 3

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