magnesium;2,2-dimethoxyethanol;hydride

C4H12MgO3 — CID 174500323

IUPACmagnesium;2,2-dimethoxyethanol;hydride
SMILESCOC(CO)OC.[H-].[H-].[Mg+2]
InChIInChI=1S/C4H10O3.Mg.2H/c1-6-4(3-5)7-2;;;/h4-5H,3H2,1-2H3;;;/q;+2;2*-1
InChIKeyPTVYGLBTSMSNGK-UHFFFAOYSA-N
MW132.44 g/mol
LogP-0.56
Rot. Bonds3

About magnesium;2,2-dimethoxyethanol;hydride

magnesium;2,2-dimethoxyethanol;hydride (PubChem CID 174500323) has the molecular formula C4H12MgO3 and a molecular weight of 132.44 g/mol. Its IUPAC name is magnesium;2,2-dimethoxyethanol;hydride.

Molecular Properties

Compound Namemagnesium;2,2-dimethoxyethanol;hydride
PubChem CID174500323
Molecular FormulaC4H12MgO3
Molecular Weight132.44 g/mol
Exact Mass132.06
IUPAC Namemagnesium;2,2-dimethoxyethanol;hydride
SMILESCOC(CO)OC.[H-].[H-].[Mg+2]
InChIInChI=1S/C4H10O3.Mg.2H/c1-6-4(3-5)7-2;;;/h4-5H,3H2,1-2H3;;;/q;+2;2*-1
InChIKeyPTVYGLBTSMSNGK-UHFFFAOYSA-N
XLogP-0.56
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.44
LogP ≤ 5-0.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium;2,2-dimethoxyethanol;hydride?
The IUPAC name of magnesium;2,2-dimethoxyethanol;hydride (CID 174500323) is magnesium;2,2-dimethoxyethanol;hydride.
What is the SMILES notation for magnesium;2,2-dimethoxyethanol;hydride?
The canonical SMILES for magnesium;2,2-dimethoxyethanol;hydride is COC(CO)OC.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;2,2-dimethoxyethanol;hydride?
The InChIKey is PTVYGLBTSMSNGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3.Mg.2H/c1-6-4(3-5)7-2;;;/h4-5H,3H2,1-2H3;;;/q;+2;2*-1.
What are the key properties of magnesium;2,2-dimethoxyethanol;hydride?
magnesium;2,2-dimethoxyethanol;hydride has a molecular weight of 132.44 g/mol, XLogP of -0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;2,2-dimethoxyethanol;hydride is sourced from PubChem (CID 174500323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).