Mercury perchlorate--water (1/2/1)

CAS Number: 304656-34-6
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[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.O.[Hg+2]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Hg.O4Cl.O4Cl.H2O
Molecular Weight
99.449
Drug-likeness
-13.558
CAS
304656-34-6
InChI key
OOYSCVKOXPZTGW-UHFFFAOYSA-L
SMILES
[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.O.[Hg+2]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 304656-34-6
Molecule Name Mercury perchlorate--water (1/2/1)
Molecular Formula Hg.O4Cl.O4Cl.H2O
SMILES [O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.O.[Hg+2]
InChI InChI=1S/2ClHO4.Hg.H2O/c2*2-1(3,4)5;;/h2*(H,2,3,4,5);;1H2/q;;+2;/p-2
InChI Key OOYSCVKOXPZTGW-UHFFFAOYSA-L
CanonicalSyTyLFy 3d83474b04532e87
TotalMolweight 417.503
Molecular Weight 99.449
MonoisotopicMass 98.948512
CLogP -4.1158
CLogS 0.448
H Acceptors 4
TotalSurfaceArea 75.57
Relative PSA 0.70663
PolarSurfaceArea 74.27
Drug-likeness -13.558
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions Cl,Br,I on N,O,P,S,Se,I
Shape Index 0.6
Molecular Complexity 0.80472
Fragments 4
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 1
Symmetricatoms 2

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