Lutetium(III) nitrate, hexahydrate (1:3:6)

CAS Number: 36549-50-5
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[O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.O.O.O.O.O.[Lu+3]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Lu.NO3.NO3.NO3.H2O.H2O.H2O.H2O.H2O.H2O
Molecular Weight
62.004
Drug-likeness
-9.919
CAS
36549-50-5
InChI key
OHGDHCSVOXRLSU-UHFFFAOYSA-N
SMILES
[O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.O.O.O.O.O.[Lu+3]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 36549-50-5
Molecule Name Lutetium(III) nitrate, hexahydrate (1:3:6)
Molecular Formula Lu.NO3.NO3.NO3.H2O.H2O.H2O.H2O.H2O.H2O
SMILES [O-][N+]([O-])=O.[O-][N+]([O-])=O.[O-][N+]([O-])=O.O.O.O.O.O.O.[Lu+3]
InChI InChI=1S/Lu.3NO3.6H2O/c;3*2-1(3)4;;;;;;/h;;;;6*1H2/q+3;3*-1;;;;;;
InChI Key OHGDHCSVOXRLSU-UHFFFAOYSA-N
CanonicalSyTyLFy 4110c2bbf072238b
TotalMolweight 469.071
Molecular Weight 62.004
MonoisotopicMass 61.987819
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 10
Non HAtoms 4
NonCHAtoms 4
Electronegative Atoms 4
Sp3Atoms 2
Symmetricatoms 1
AcidicOxygens 2

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