Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)

C₃₆H₃₆CoN₆O₆+2 — CID 140694735

About Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)

Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine) (PubChem CID 140694735) has the molecular formula C₃₆H₃₆CoN₆O₆+2 and a molecular weight of 707.65 g/mol. Its IUPAC name is cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine).

Molecular Properties

• Compound Name: Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)
• PubChem CID: 140694735
• Molecular Formula: C₃₆H₃₆CoN₆O₆+2
• Molecular Weight: 707.65 g/mol
• Exact Mass: 707.20
• IUPAC Name: cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)
• SMILES: COc1cccnc1-c1ncccc1OC.COc1cccnc1-c1ncccc1OC.COc1cccnc1-c1ncccc1OC.[Co+2]
• InChI: InChI=1S/3C12H12N2O2.Co/c3*1-15-9-5-3-7-13-11(9)12-10(16-2)6-4-8-14-12;/h3*3-8H,1-2H3;/q;;;+2
• InChIKey: HGJYJWNMVZNZDD-UHFFFAOYSA-N
• XLogP: 6.48
• TPSA: 132.72 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 9
• Heavy Atoms: 49
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	707.65
LogP ≤ 5	6.48
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)?

The IUPAC name of Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine) (CID 140694735) is cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine).

What is the SMILES notation for Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)?

The canonical SMILES for Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine) is COc1cccnc1-c1ncccc1OC.COc1cccnc1-c1ncccc1OC.COc1cccnc1-c1ncccc1OC.[Co+2].

What is the InChIKey of Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)?

The InChIKey is HGJYJWNMVZNZDD-UHFFFAOYSA-N. The full InChI is InChI=1S/3C12H12N2O2.Co/c3*1-15-9-5-3-7-13-11(9)12-10(16-2)6-4-8-14-12;/h3*3-8H,1-2H3;/q;;;+2.

What are the key properties of Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine)?

Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine) has a molecular weight of 707.65 g/mol, XLogP of 6.48, 9 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for Cobalt(2+);tris(3-methoxy-2-(3-methoxy-2-pyridinyl)pyridine) is sourced from PubChem (CID 140694735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 140694735 — identifiers, structure, computed properties (public domain)

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