Magnesium bis(2-methylpropan-2-ide)

CAS Number: 14627-81-7
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C[C-](C)C.C[C-](C)C.[Mg+2]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
Mg.C4H9.C4H9
Molecular Weight
57.1155
Drug-likeness
-2.3575
CAS
14627-81-7
InChI key
IZWPPZMYNSBLNI-UHFFFAOYSA-N
SMILES
C[C-](C)C.C[C-](C)C.[Mg+2]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 14627-81-7
Molecule Name Magnesium bis(2-methylpropan-2-ide)
Molecular Formula Mg.C4H9.C4H9
SMILES C[C-](C)C.C[C-](C)C.[Mg+2]
InChI InChI=1S/2C4H9.Mg/c2*1-4(2)3;/h2*1-3H3;/q2*-1;+2
InChI Key IZWPPZMYNSBLNI-UHFFFAOYSA-N
CanonicalSyTyLFy 2788aed2d59c57f4
TotalMolweight 138.536
Molecular Weight 57.1155
MonoisotopicMass 57.070425
CLogP 1.4658
CLogS -1.414
TotalSurfaceArea 57.03
Drug-likeness -2.3575
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Fragments 3
Non HAtoms 4
Sp3Atoms 4
Symmetricatoms 2

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