CID 172760966

CaCuFeMgZn — CID 172760966

IUPAC—
SMILES[Ca].[Cu].[Fe].[Mg].[Zn]
InChIInChI=1S/Ca.Cu.Fe.Mg.Zn
InChIKeyLRFYEYKXOWDKDY-UHFFFAOYSA-N
MW249.16 g/mol
LogP-0.77
Rot. Bonds

About CID 172760966

CID 172760966 (PubChem CID 172760966) has the molecular formula CaCuFeMgZn and a molecular weight of 249.16 g/mol.

Molecular Properties

Compound NameCID 172760966
PubChem CID172760966
Molecular FormulaCaCuFeMgZn
Molecular Weight249.16 g/mol
Exact Mass246.74
IUPAC Name—
SMILES[Ca].[Cu].[Fe].[Mg].[Zn]
InChIInChI=1S/Ca.Cu.Fe.Mg.Zn
InChIKeyLRFYEYKXOWDKDY-UHFFFAOYSA-N
XLogP-0.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.16
LogP ≤ 5-0.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 172760966?
The IUPAC name of CID 172760966 (CID 172760966) is not available.
What is the SMILES notation for CID 172760966?
The canonical SMILES for CID 172760966 is [Ca].[Cu].[Fe].[Mg].[Zn].
What is the InChIKey of CID 172760966?
The InChIKey is LRFYEYKXOWDKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.Cu.Fe.Mg.Zn.
What are the key properties of CID 172760966?
CID 172760966 has a molecular weight of 249.16 g/mol, XLogP of -0.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172760966 is sourced from PubChem (CID 172760966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).