Mercury(II) methanesulfonate

CAS Number: 29526-41-8
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CS([O-])(=O)=O.CS([O-])(=O)=O.[Hg+2]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Hg.CH3O3S.CH3O3S
Molecular Weight
95.0978
Drug-likeness
-5.1124
CAS
29526-41-8
InChI key
FQQRAQNLVACMPX-UHFFFAOYSA-L
SMILES
CS([O-])(=O)=O.CS([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 29526-41-8
Molecule Name Mercury(II) methanesulfonate
Molecular Formula Hg.CH3O3S.CH3O3S
SMILES CS([O-])(=O)=O.CS([O-])(=O)=O.[Hg+2]
InChI InChI=1S/2CH4O3S.Hg/c2*1-5(2,3)4;/h2*1H3,(H,2,3,4);/q;;+2/p-2
InChI Key FQQRAQNLVACMPX-UHFFFAOYSA-L
CanonicalSyTyLFy 61559cbd0f8e804a
TotalMolweight 390.786
Molecular Weight 95.0978
MonoisotopicMass 94.98029
CLogP -3.0677
CLogS 0.024
H Acceptors 3
TotalSurfaceArea 61.87
Relative PSA 0.69274
PolarSurfaceArea 65.58
Drug-likeness -5.1124
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecular Complexity 0.89588
Fragments 3
Non HAtoms 5
NonCHAtoms 4
Electronegative Atoms 4
Sp3Atoms 3
Symmetricatoms 1
AcidicOxygens 1

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