Potassium (~15~N,~18~O_3_)nitrate

CAS Number: 285978-22-5
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[18O-][15N+]([18O-])=[18O].[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.NO3
Molecular Weight
68.9976
Drug-likeness
-9.919
CAS
285978-22-5
InChI key
FGIUAXJPYTZDNR-QKBJONFOSA-N
SMILES
[18O-][15N+]([18O-])=[18O].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 285978-22-5
Molecule Name Potassium (~15~N,~18~O_3_)nitrate
Molecular Formula K.NO3
SMILES [18O-][15N+]([18O-])=[18O].[K+]
InChI InChI=1S/K.NO3/c;2-1(3)4/q+1;-1/i;1+1,2+2,3+2,4+2
InChI Key FGIUAXJPYTZDNR-QKBJONFOSA-N
CanonicalSyTyLFy c11b88ebf1b63a27
TotalMolweight 108.096
Molecular Weight 68.9976
MonoisotopicMass 68.9975902
CLogP -0.8585
CLogS -1.108
H Acceptors 4
TotalSurfaceArea 43.46
Relative PSA 1
PolarSurfaceArea 62.89
Drug-likeness -9.919
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Fragments 2
Non HAtoms 4
NonCHAtoms 4
Electronegative Atoms 4
Sp3Atoms 2
Symmetricatoms 1
AcidicOxygens 2

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