Sulfuric acid, hafnium(4+) salt (2:1)

CAS Number: 15823-43-5
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[O-]S([O-])(=O)=O.[O-]S([O-])(=O)=O.[Hf+4]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Hf.O4S.O4S
Molecular Weight
96.062
Drug-likeness
-10.57
CAS
15823-43-5
InChI key
NXKAMHRHVYEHER-UHFFFAOYSA-J
SMILES
[O-]S([O-])(=O)=O.[O-]S([O-])(=O)=O.[Hf+4]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 15823-43-5
Molecule Name Sulfuric acid, hafnium(4+) salt (2:1)
Molecular Formula Hf.O4S.O4S
SMILES [O-]S([O-])(=O)=O.[O-]S([O-])(=O)=O.[Hf+4]
InChI InChI=1S/Hf.2H2O4S/c;2*1-5(2,3)4/h;2*(H2,1,2,3,4)/q+4;;/p-4
InChI Key NXKAMHRHVYEHER-UHFFFAOYSA-J
CanonicalSyTyLFy c14b4c9dc4d2d9b9
TotalMolweight 370.614
Molecular Weight 96.062
MonoisotopicMass 95.95173
CLogP -5.9055
CLogS 1.524
H Acceptors 4
TotalSurfaceArea 57.14
Relative PSA 1
PolarSurfaceArea 88.64
Drug-likeness -10.57
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 3
Symmetricatoms 2
AcidicOxygens 2

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