cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate

C33H48CoN2O6Si2 — CID 159184050

About cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate

cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate (PubChem CID 159184050) has the molecular formula C33H48CoN2O6Si2 and a molecular weight of 683.86 g/mol. Its IUPAC name is cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate.

Molecular Properties

• Compound Name: cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate
• PubChem CID: 159184050
• Molecular Formula: C33H48CoN2O6Si2
• Molecular Weight: 683.86 g/mol
• Exact Mass: 683.24
• IUPAC Name: cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate
• SMILES: CC(=O)[O-].CC(=O)[O-].Cc1cc([Si](C)(C)C)cc(/C=N\C2CC3CCC2(/N=C/c2cc([Si](C)(C)C)cc(C)c2O)C3)c1O.[Co+2]
• InChI: InChI=1S/C29H42N2O2Si2.2C2H4O2.Co/c1-19-11-24(34(3,4)5)14-22(27(19)32)17-30-26-13-21-9-10-29(26,16-21)31-18-23-15-25(35(6,7)8)12-20(2)28(23)33;2*1-2(3)4;/h11-12,14-15,17-18,21,26,32-33H,9-10,13,16H2,1-8H3;2*1H3,(H,3,4);/q;;;+2/p-2/b30-17-,31-18+
• InChIKey: UDHHSZMDKNUDPF-FLSAVRHASA-L
• XLogP: 3.16
• TPSA: 145.44 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 6
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	683.86
LogP ≤ 5	3.16
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate?

The IUPAC name of cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate (CID 159184050) is cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate.

What is the SMILES notation for cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate?

The canonical SMILES for cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate is CC(=O)[O-].CC(=O)[O-].Cc1cc([Si](C)(C)C)cc(/C=N\C2CC3CCC2(/N=C/c2cc([Si](C)(C)C)cc(C)c2O)C3)c1O.[Co+2].

What is the InChIKey of cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate?

The InChIKey is UDHHSZMDKNUDPF-FLSAVRHASA-L. The full InChI is InChI=1S/C29H42N2O2Si2.2C2H4O2.Co/c1-19-11-24(34(3,4)5)14-22(27(19)32)17-30-26-13-21-9-10-29(26,16-21)31-18-23-15-25(35(6,7)8)12-20(2)28(23)33;2*1-2(3)4;/h11-12,14-15,17-18,21,26,32-33H,9-10,13,16H2,1-8H3;2*1H3,(H,3,4);/q;;;+2/p-2/b30-17-,31-18+;;;.

What are the key properties of cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate?

cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate has a molecular weight of 683.86 g/mol, XLogP of 3.16, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for cobalt(2+);2-[[1-[(2-hydroxy-3-methyl-5-trimethylsilylphenyl)methylideneamino]-2-bicyclo[2.2.1]heptanyl]iminomethyl]-6-methyl-4-trimethylsilylphenol;diacetate is sourced from PubChem (CID 159184050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).