trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane

C27H58O7Si5 — CID 70024595

About trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane

trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane (PubChem CID 70024595) has the molecular formula C27H58O7Si5 and a molecular weight of 635.18 g/mol. Its IUPAC name is trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane.

Molecular Properties

• Compound Name: trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane
• PubChem CID: 70024595
• Molecular Formula: C27H58O7Si5
• Molecular Weight: 635.18 g/mol
• Exact Mass: 634.30
• IUPAC Name: trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane
• SMILES: C=CCCCC[Si]1(C)O[Si](C)(CCCCC=C)O[Si](C)(CC[Si](OC)(OC)OC)O[Si](C)(CCCCC=C)O1
• InChI: InChI=1S/C27H58O7Si5/c1-11-14-17-20-23-35(7)31-36(8,24-21-18-15-12-2)33-38(10,26-27-39(28-4,29-5)30-6)34-37(9,32-35)25-22-19-16-13-3/h11-13H,1-3,14-27H2,4-10H3
• InChIKey: CYQZXFDCSKQIPF-UHFFFAOYSA-N
• XLogP: 8.30
• TPSA: 64.61 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 21
• Heavy Atoms: 39
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	635.18
LogP ≤ 5	8.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane?

The IUPAC name of trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane (CID 70024595) is trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane.

What is the SMILES notation for trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane?

The canonical SMILES for trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane is C=CCCCC[Si]1(C)O[Si](C)(CCCCC=C)O[Si](C)(CC[Si](OC)(OC)OC)O[Si](C)(CCCCC=C)O1.

What is the InChIKey of trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane?

The InChIKey is CYQZXFDCSKQIPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H58O7Si5/c1-11-14-17-20-23-35(7)31-36(8,24-21-18-15-12-2)33-38(10,26-27-39(28-4,29-5)30-6)34-37(9,32-35)25-22-19-16-13-3/h11-13H,1-3,14-27H2,4-10H3.

What are the key properties of trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane?

trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane has a molecular weight of 635.18 g/mol, XLogP of 8.30, 21 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for trimethoxy-[2-[4,6,8-tris(hex-5-enyl)-2,4,6,8-tetramethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl]ethyl]silane is sourced from PubChem (CID 70024595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).