Molybdenum(4+);tetrakis(pentane-2,4-dione)

C₂₀H₃₂MoO₈+4 — CID 11705952

About Molybdenum(4+);tetrakis(pentane-2,4-dione)

Molybdenum(4+);tetrakis(pentane-2,4-dione) (PubChem CID 11705952) has the molecular formula C₂₀H₃₂MoO₈+4 and a molecular weight of 496.41 g/mol. Its IUPAC name is molybdenum(4+);tetrakis(pentane-2,4-dione).

Molecular Properties

• Compound Name: Molybdenum(4+);tetrakis(pentane-2,4-dione)
• PubChem CID: 11705952
• Molecular Formula: C₂₀H₃₂MoO₈+4
• Molecular Weight: 496.41 g/mol
• Exact Mass: 498.11
• IUPAC Name: molybdenum(4+);tetrakis(pentane-2,4-dione)
• SMILES: CC(=O)CC(C)=O.CC(=O)CC(C)=O.CC(=O)CC(C)=O.CC(=O)CC(C)=O.[Mo+4]
• InChI: InChI=1S/4C5H8O2.Mo/c4*1-4(6)3-5(2)7;/h4*3H2,1-2H3;/q;;;;+4
• InChIKey: FHWMRAPJTMZTFL-UHFFFAOYSA-N
• XLogP: 2.22
• TPSA: 136.56 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 8
• Heavy Atoms: 29
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	496.41
LogP ≤ 5	2.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Molybdenum(4+);tetrakis(pentane-2,4-dione)?

The IUPAC name of Molybdenum(4+);tetrakis(pentane-2,4-dione) (CID 11705952) is molybdenum(4+);tetrakis(pentane-2,4-dione).

What is the SMILES notation for Molybdenum(4+);tetrakis(pentane-2,4-dione)?

The canonical SMILES for Molybdenum(4+);tetrakis(pentane-2,4-dione) is CC(=O)CC(C)=O.CC(=O)CC(C)=O.CC(=O)CC(C)=O.CC(=O)CC(C)=O.[Mo+4].

What is the InChIKey of Molybdenum(4+);tetrakis(pentane-2,4-dione)?

The InChIKey is FHWMRAPJTMZTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/4C5H8O2.Mo/c4*1-4(6)3-5(2)7;/h4*3H2,1-2H3;/q;;;;+4.

What are the key properties of Molybdenum(4+);tetrakis(pentane-2,4-dione)?

Molybdenum(4+);tetrakis(pentane-2,4-dione) has a molecular weight of 496.41 g/mol, XLogP of 2.22, 8 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for Molybdenum(4+);tetrakis(pentane-2,4-dione) is sourced from PubChem (CID 11705952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 11705952 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.