Magnesium carbonate--water (1/1/1)

CAS Number: 16509-24-3
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[O-]C([O-])=O.O.[Mg+2]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Mg.CO3.H2O
Molecular Weight
60.008
Drug-likeness
-4.9252
CAS
16509-24-3
InChI key
OUHCLAKJJGMPSW-UHFFFAOYSA-L
SMILES
[O-]C([O-])=O.O.[Mg+2]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 16509-24-3
Molecule Name Magnesium carbonate--water (1/1/1)
Molecular Formula Mg.CO3.H2O
SMILES [O-]C([O-])=O.O.[Mg+2]
InChI InChI=1S/CH2O3.Mg.H2O/c2-1(3)4;;/h(H2,2,3,4);;1H2/q;+2;/p-2
InChI Key OUHCLAKJJGMPSW-UHFFFAOYSA-L
CanonicalSyTyLFy 2b8279c0731abb8c
TotalMolweight 102.328
Molecular Weight 60.008
MonoisotopicMass 59.984745
CLogP -4.6758
CLogS -0.646
H Acceptors 3
TotalSurfaceArea 46.31
Relative PSA 0.89829
PolarSurfaceArea 63.19
Drug-likeness -4.9252
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Fragments 3
Non HAtoms 4
NonCHAtoms 3
Electronegative Atoms 3
Sp3Atoms 2
Symmetricatoms 1
AcidicOxygens 2

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