calcium;magnesium;iron(2+);manganese(2+);disilicate

CaFeMgMnO8Si2 — CID 173023786

IUPACcalcium;magnesium;iron(2+);manganese(2+);disilicate
SMILES[Ca+2].[Fe+2].[Mg+2].[Mn+2].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-]
InChIInChI=1S/Ca.Fe.Mg.Mn.2O4Si/c;;;;2*1-5(2,3)4/q4*+2;2*-4
InChIKeyGMUYWOMYHUJONW-UHFFFAOYSA-N
MW359.33 g/mol
LogP-11.04
Rot. Bonds

About calcium;magnesium;iron(2+);manganese(2+);disilicate

calcium;magnesium;iron(2+);manganese(2+);disilicate (PubChem CID 173023786) has the molecular formula CaFeMgMnO8Si2 and a molecular weight of 359.33 g/mol. Its IUPAC name is calcium;magnesium;iron(2+);manganese(2+);disilicate.

Molecular Properties

Compound Namecalcium;magnesium;iron(2+);manganese(2+);disilicate
PubChem CID173023786
Molecular FormulaCaFeMgMnO8Si2
Molecular Weight359.33 g/mol
Exact Mass358.73
IUPAC Namecalcium;magnesium;iron(2+);manganese(2+);disilicate
SMILES[Ca+2].[Fe+2].[Mg+2].[Mn+2].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-]
InChIInChI=1S/Ca.Fe.Mg.Mn.2O4Si/c;;;;2*1-5(2,3)4/q4*+2;2*-4
InChIKeyGMUYWOMYHUJONW-UHFFFAOYSA-N
XLogP-11.04
TPSA184.48 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.33
LogP ≤ 5-11.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of calcium;magnesium;iron(2+);manganese(2+);disilicate?
The IUPAC name of calcium;magnesium;iron(2+);manganese(2+);disilicate (CID 173023786) is calcium;magnesium;iron(2+);manganese(2+);disilicate.
What is the SMILES notation for calcium;magnesium;iron(2+);manganese(2+);disilicate?
The canonical SMILES for calcium;magnesium;iron(2+);manganese(2+);disilicate is [Ca+2].[Fe+2].[Mg+2].[Mn+2].[O-][Si]([O-])([O-])[O-].[O-][Si]([O-])([O-])[O-].
What is the InChIKey of calcium;magnesium;iron(2+);manganese(2+);disilicate?
The InChIKey is GMUYWOMYHUJONW-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.Fe.Mg.Mn.2O4Si/c;;;;2*1-5(2,3)4/q4*+2;2*-4.
What are the key properties of calcium;magnesium;iron(2+);manganese(2+);disilicate?
calcium;magnesium;iron(2+);manganese(2+);disilicate has a molecular weight of 359.33 g/mol, XLogP of -11.04, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;magnesium;iron(2+);manganese(2+);disilicate is sourced from PubChem (CID 173023786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).