CID 57382303

Ca3MgO8Si2-4 — CID 57382303

IUPAC—
SMILES[Ca+2].[Ca+2].[Ca+2].[Mg+2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Si+2].[Si+2]
InChIInChI=1S/3Ca.Mg.8O.2Si/q4*+2;8*-2;2*+2
InChIKeyAQNRONGWTYZBLB-UHFFFAOYSA-N
MW328.70 g/mol
LogP-3.24
Rot. Bonds

About CID 57382303

CID 57382303 (PubChem CID 57382303) has the molecular formula Ca3MgO8Si2-4 and a molecular weight of 328.70 g/mol.

Molecular Properties

Compound NameCID 57382303
PubChem CID57382303
Molecular FormulaCa3MgO8Si2-4
Molecular Weight328.70 g/mol
Exact Mass327.79
IUPAC Name—
SMILES[Ca+2].[Ca+2].[Ca+2].[Mg+2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Si+2].[Si+2]
InChIInChI=1S/3Ca.Mg.8O.2Si/q4*+2;8*-2;2*+2
InChIKeyAQNRONGWTYZBLB-UHFFFAOYSA-N
XLogP-3.24
TPSA228.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.70
LogP ≤ 5-3.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 CID 57382303?
The IUPAC name of CID 57382303 (CID 57382303) is not available.
What is the SMILES notation for CID 57382303?
The canonical SMILES for CID 57382303 is [Ca+2].[Ca+2].[Ca+2].[Mg+2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Si+2].[Si+2].
What is the InChIKey of CID 57382303?
The InChIKey is AQNRONGWTYZBLB-UHFFFAOYSA-N. The full InChI is InChI=1S/3Ca.Mg.8O.2Si/q4*+2;8*-2;2*+2.
What are the key properties of CID 57382303?
CID 57382303 has a molecular weight of 328.70 g/mol, XLogP of -3.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57382303 is sourced from PubChem (CID 57382303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).