tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane

C22H60O2Si8 — CID 57354853

IUPACtris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane
SMILESC[Si](C)(C)[Si](OC=CCCO[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C22H60O2Si8/c1-25(2,3)31(26(4,5)6,27(7,8)9)23-21-19-20-22-24-32(28(10,11)12,29(13,14)15)30(16,17)18/h19,21H,20,22H2,1-18H3
InChIKeyHTQDUGCKLDHQMH-UHFFFAOYSA-N
MW581.41 g/mol
LogP8.31
Rot. Bonds12

About tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane

tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane (PubChem CID 57354853) has the molecular formula C22H60O2Si8 and a molecular weight of 581.41 g/mol. Its IUPAC name is tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane.

Molecular Properties

Compound Nametris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane
PubChem CID57354853
Molecular FormulaC22H60O2Si8
Molecular Weight581.41 g/mol
Exact Mass580.27
IUPAC Nametris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane
SMILESC[Si](C)(C)[Si](OC=CCCO[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C22H60O2Si8/c1-25(2,3)31(26(4,5)6,27(7,8)9)23-21-19-20-22-24-32(28(10,11)12,29(13,14)15)30(16,17)18/h19,21H,20,22H2,1-18H3
InChIKeyHTQDUGCKLDHQMH-UHFFFAOYSA-N
XLogP8.31
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500581.41
LogP ≤ 58.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane?
The IUPAC name of tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane (CID 57354853) is tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane.
What is the SMILES notation for tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane?
The canonical SMILES for tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane is C[Si](C)(C)[Si](OC=CCCO[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane?
The InChIKey is HTQDUGCKLDHQMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H60O2Si8/c1-25(2,3)31(26(4,5)6,27(7,8)9)23-21-19-20-22-24-32(28(10,11)12,29(13,14)15)30(16,17)18/h19,21H,20,22H2,1-18H3.
What are the key properties of tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane?
tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane has a molecular weight of 581.41 g/mol, XLogP of 8.31, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tris(trimethylsilyl)-[4-tris(trimethylsilyl)silyloxybut-1-enoxy]silane is sourced from PubChem (CID 57354853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).