Manganese bis(dihydrogen phosphate)

CAS Number: 18718-07-5
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[O-]P(O)(O)=O.[O-]P(O)(O)=O.[Mn+2]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Mn.H2O4P.H2O4P
Molecular Weight
96.9859
Drug-likeness
-14.097
CAS
18718-07-5
InChI key
NAAXGLXYRDSIRS-UHFFFAOYSA-L
SMILES
[O-]P(O)(O)=O.[O-]P(O)(O)=O.[Mn+2]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 18718-07-5
Molecule Name Manganese bis(dihydrogen phosphate)
Molecular Formula Mn.H2O4P.H2O4P
SMILES [O-]P(O)(O)=O.[O-]P(O)(O)=O.[Mn+2]
InChI InChI=1S/Mn.2H3O4P/c;2*1-5(2,3)4/h;2*(H3,1,2,3,4)/q+2;;/p-2
InChI Key NAAXGLXYRDSIRS-UHFFFAOYSA-L
CanonicalSyTyLFy d9645b270af7ad2d
TotalMolweight 248.91
Molecular Weight 96.9859
MonoisotopicMass 96.969072
CLogP -6.2869
CLogS 1.958
H Acceptors 4
H Donors 2
TotalSurfaceArea 57.5
Relative PSA 1
PolarSurfaceArea 90.4
Drug-likeness -14.097
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecular Complexity 0.80472
Fragments 3
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 4
Symmetricatoms 1
AcidicOxygens 3

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