2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane

C18H34OSi — CID 91714393

About 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane

2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane (PubChem CID 91714393) has the molecular formula C18H34OSi and a molecular weight of 294.56 g/mol. Its IUPAC name is 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane.

Molecular Properties

• Compound Name: 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane
• PubChem CID: 91714393
• Molecular Formula: C18H34OSi
• Molecular Weight: 294.56 g/mol
• Exact Mass: 294.24
• IUPAC Name: 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane
• SMILES: C=C1CCCC2(C)CCC(C(C)(C)O[Si](C)(C)C)CC12
• InChI: InChI=1S/C18H34OSi/c1-14-9-8-11-18(4)12-10-15(13-16(14)18)17(2,3)19-20(5,6)7/h15-16H,1,8-13H2,2-7H3
• InChIKey: YWUMNHGSONHGAP-UHFFFAOYSA-N
• XLogP: 5.78
• TPSA: 9.23 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 3
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	294.56
LogP ≤ 5	5.78
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane?

The IUPAC name of 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane (CID 91714393) is 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane.

What is the SMILES notation for 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane?

The canonical SMILES for 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane is C=C1CCCC2(C)CCC(C(C)(C)O[Si](C)(C)C)CC12.

What is the InChIKey of 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane?

The InChIKey is YWUMNHGSONHGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34OSi/c1-14-9-8-11-18(4)12-10-15(13-16(14)18)17(2,3)19-20(5,6)7/h15-16H,1,8-13H2,2-7H3.

What are the key properties of 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane?

2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane has a molecular weight of 294.56 g/mol, XLogP of 5.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4a-methyl-8-methylidene-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl)propan-2-yloxy-trimethylsilane is sourced from PubChem (CID 91714393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).