magnesium;3,3-dimethoxydioxirane;hydride

C3H8MgO4 — CID 174272624

IUPACmagnesium;3,3-dimethoxydioxirane;hydride
SMILESCOC1(OC)OO1.[H-].[H-].[Mg+2]
InChIInChI=1S/C3H6O4.Mg.2H/c1-4-3(5-2)6-7-3;;;/h1-2H3;;;/q;+2;2*-1
InChIKeyGYDRSJLPYODHJG-UHFFFAOYSA-N
MW132.40 g/mol
LogP-0.30
Rot. Bonds2

About magnesium;3,3-dimethoxydioxirane;hydride

magnesium;3,3-dimethoxydioxirane;hydride (PubChem CID 174272624) has the molecular formula C3H8MgO4 and a molecular weight of 132.40 g/mol. Its IUPAC name is magnesium;3,3-dimethoxydioxirane;hydride.

Molecular Properties

Compound Namemagnesium;3,3-dimethoxydioxirane;hydride
PubChem CID174272624
Molecular FormulaC3H8MgO4
Molecular Weight132.40 g/mol
Exact Mass132.03
IUPAC Namemagnesium;3,3-dimethoxydioxirane;hydride
SMILESCOC1(OC)OO1.[H-].[H-].[Mg+2]
InChIInChI=1S/C3H6O4.Mg.2H/c1-4-3(5-2)6-7-3;;;/h1-2H3;;;/q;+2;2*-1
InChIKeyGYDRSJLPYODHJG-UHFFFAOYSA-N
XLogP-0.30
TPSA43.52 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.40
LogP ≤ 5-0.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

potassium 3-methoxydioxiran-3-olate
CID 88712055
lanthanum;3-methoxydioxiran-3-ol
CID 175608723
azane;3-methoxydioxiran-3-ol
CID 174848331
lithium;hydride;methyl hypobromite
CID 174405384
magnesium;hydride;methyl hypoiodite
CID 173055944
dilithium;hydride;methoxymethane
CID 174929904
2-methoxy-2,4,4-trimethyl-5,5-bis(trideuteriomethyl)-1,3-dioxolane
CID 131860515
ethenyl-(ethenyl-methoxy-methylsilyl)-methoxy-methylsilane
CID 19809310
2-methoxy-2-methylaziridine
CID 21493693
1,2,3-trimethoxy-4-(2,3,4-trimethoxy-1-tricyclo[1.1.0.02,4]butanyl)tricyclo[1.1.0.02,4]butane
CID 102032876
magnesium;hydride;trimethyl borate
CID 173395852
2-methoxyoxiran-2-ol
CID 123437916

Frequently Asked Questions

What is the IUPAC name of magnesium;3,3-dimethoxydioxirane;hydride?
The IUPAC name of magnesium;3,3-dimethoxydioxirane;hydride (CID 174272624) is magnesium;3,3-dimethoxydioxirane;hydride.
What is the SMILES notation for magnesium;3,3-dimethoxydioxirane;hydride?
The canonical SMILES for magnesium;3,3-dimethoxydioxirane;hydride is COC1(OC)OO1.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;3,3-dimethoxydioxirane;hydride?
The InChIKey is GYDRSJLPYODHJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O4.Mg.2H/c1-4-3(5-2)6-7-3;;;/h1-2H3;;;/q;+2;2*-1.
What are the key properties of magnesium;3,3-dimethoxydioxirane;hydride?
magnesium;3,3-dimethoxydioxirane;hydride has a molecular weight of 132.40 g/mol, XLogP of -0.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;3,3-dimethoxydioxirane;hydride is sourced from PubChem (CID 174272624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).