Magnesium bis(2-methylprop-1-en-1-ide)

CAS Number: 69219-07-4
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CC(C)=[CH-].CC(C)=[CH-].[Mg+2]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Mg.C4H7.C4H7
Molecular Weight
55.0996
Drug-likeness
-2.8841
CAS
69219-07-4
InChI key
UDRTVPWYEGKVOD-UHFFFAOYSA-N
SMILES
CC(C)=[CH-].CC(C)=[CH-].[Mg+2]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 69219-07-4
Molecule Name Magnesium bis(2-methylprop-1-en-1-ide)
Molecular Formula Mg.C4H7.C4H7
SMILES CC(C)=[CH-].CC(C)=[CH-].[Mg+2]
InChI InChI=1S/2C4H7.Mg/c2*1-4(2)3;/h2*1H,2-3H3;/q2*-1;+2
InChI Key UDRTVPWYEGKVOD-UHFFFAOYSA-N
CanonicalSyTyLFy 2a23bc22cf1b17c6
TotalMolweight 134.504
Molecular Weight 55.0996
MonoisotopicMass 55.054775
CLogP 1.4233
CLogS -1.317
TotalSurfaceArea 42.73
Drug-likeness -2.8841
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Fragments 3
Non HAtoms 4
Sp3Atoms 2
Symmetricatoms 1

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