tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane

C26H46O2Si2 — CID 141353569

IUPACtris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane
SMILESC=CC[Si](CC=C)(CC=C)OCCCC(CCCC)O[Si](CC=C)(CC=C)CC=C
InChIInChI=1S/C26H46O2Si2/c1-8-15-17-26(28-30(23-12-5,24-13-6)25-14-7)18-16-19-27-29(20-9-2,21-10-3)22-11-4/h9-14,26H,2-8,15-25H2,1H3
InChIKeyQZQYZQAUAWWJAJ-UHFFFAOYSA-N
MW446.82 g/mol
LogP8.37
Rot. Bonds22

About tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane

tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane (PubChem CID 141353569) has the molecular formula C26H46O2Si2 and a molecular weight of 446.82 g/mol. Its IUPAC name is tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane.

Molecular Properties

Compound Nametris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane
PubChem CID141353569
Molecular FormulaC26H46O2Si2
Molecular Weight446.82 g/mol
Exact Mass446.30
IUPAC Nametris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane
SMILESC=CC[Si](CC=C)(CC=C)OCCCC(CCCC)O[Si](CC=C)(CC=C)CC=C
InChIInChI=1S/C26H46O2Si2/c1-8-15-17-26(28-30(23-12-5,24-13-6)25-14-7)18-16-19-27-29(20-9-2,21-10-3)22-11-4/h9-14,26H,2-8,15-25H2,1H3
InChIKeyQZQYZQAUAWWJAJ-UHFFFAOYSA-N
XLogP8.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds22
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.82
LogP ≤ 58.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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'}

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Frequently Asked Questions

What is the IUPAC name of tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane?
The IUPAC name of tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane (CID 141353569) is tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane.
What is the SMILES notation for tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane?
The canonical SMILES for tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane is C=CC[Si](CC=C)(CC=C)OCCCC(CCCC)O[Si](CC=C)(CC=C)CC=C.
What is the InChIKey of tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane?
The InChIKey is QZQYZQAUAWWJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H46O2Si2/c1-8-15-17-26(28-30(23-12-5,24-13-6)25-14-7)18-16-19-27-29(20-9-2,21-10-3)22-11-4/h9-14,26H,2-8,15-25H2,1H3.
What are the key properties of tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane?
tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane has a molecular weight of 446.82 g/mol, XLogP of 8.37, 22 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tris(prop-2-enyl)-[1-tris(prop-2-enyl)silyloxyoctan-4-yloxy]silane is sourced from PubChem (CID 141353569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).