tributyl(8-tributylsilyloxyoct-4-ynoxy)silane

C32H66O2Si2 — CID 135048691

IUPACtributyl(8-tributylsilyloxyoct-4-ynoxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OCCCC#CCCCO[Si](CCCC)(CCCC)CCCC
InChIInChI=1S/C32H66O2Si2/c1-7-13-27-35(28-14-8-2,29-15-9-3)33-25-23-21-19-20-22-24-26-34-36(30-16-10-4,31-17-11-5)32-18-12-6/h7-18,21-32H2,1-6H3
InChIKeyTYZZAAXKDVTZAO-UHFFFAOYSA-N
MW539.05 g/mol
LogP11.27
Rot. Bonds26

About tributyl(8-tributylsilyloxyoct-4-ynoxy)silane

tributyl(8-tributylsilyloxyoct-4-ynoxy)silane (PubChem CID 135048691) has the molecular formula C32H66O2Si2 and a molecular weight of 539.05 g/mol. Its IUPAC name is tributyl(8-tributylsilyloxyoct-4-ynoxy)silane.

Molecular Properties

Compound Nametributyl(8-tributylsilyloxyoct-4-ynoxy)silane
PubChem CID135048691
Molecular FormulaC32H66O2Si2
Molecular Weight539.05 g/mol
Exact Mass538.46
IUPAC Nametributyl(8-tributylsilyloxyoct-4-ynoxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OCCCC#CCCCO[Si](CCCC)(CCCC)CCCC
InChIInChI=1S/C32H66O2Si2/c1-7-13-27-35(28-14-8-2,29-15-9-3)33-25-23-21-19-20-22-24-26-34-36(30-16-10-4,31-17-11-5)32-18-12-6/h7-18,21-32H2,1-6H3
InChIKeyTYZZAAXKDVTZAO-UHFFFAOYSA-N
XLogP11.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds26
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500539.05
LogP ≤ 511.27
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': 'triple_bond', 'substructure': 'N/A'}

Analyze tributyl(8-tributylsilyloxyoct-4-ynoxy)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

butoxy(tributyl)silane
CID 594608
tributyl(decoxy)silane
CID 523467
dibutyl-[3-[dibutyl(propoxy)silyl]propyl]-propoxysilane
CID 87145187
butoxy-[3-[butoxy(dipropyl)silyl]propyl]-dipropylsilane
CID 87143618
butoxy-dibutyl-ethylsilane
CID 141095554
heptadecoxy(tripropyl)silane
CID 632797
trihexadecyl(propoxy)silane
CID 172579393
3-bromoprop-2-ynoxy(tributyl)silane
CID 134875386
3-[butoxy(dipropyl)silyl]-N-methylpropan-1-amine
CID 141438211
dibutyl-(iodomethyl)-propoxysilane
CID 23146625
tributyl(3-phenylpropoxy)silane
CID 624018
butoxy-(3-chloropropyl)-diethylsilane
CID 140743875

Frequently Asked Questions

What is the IUPAC name of tributyl(8-tributylsilyloxyoct-4-ynoxy)silane?
The IUPAC name of tributyl(8-tributylsilyloxyoct-4-ynoxy)silane (CID 135048691) is tributyl(8-tributylsilyloxyoct-4-ynoxy)silane.
What is the SMILES notation for tributyl(8-tributylsilyloxyoct-4-ynoxy)silane?
The canonical SMILES for tributyl(8-tributylsilyloxyoct-4-ynoxy)silane is CCCC[Si](CCCC)(CCCC)OCCCC#CCCCO[Si](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl(8-tributylsilyloxyoct-4-ynoxy)silane?
The InChIKey is TYZZAAXKDVTZAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H66O2Si2/c1-7-13-27-35(28-14-8-2,29-15-9-3)33-25-23-21-19-20-22-24-26-34-36(30-16-10-4,31-17-11-5)32-18-12-6/h7-18,21-32H2,1-6H3.
What are the key properties of tributyl(8-tributylsilyloxyoct-4-ynoxy)silane?
tributyl(8-tributylsilyloxyoct-4-ynoxy)silane has a molecular weight of 539.05 g/mol, XLogP of 11.27, 26 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(8-tributylsilyloxyoct-4-ynoxy)silane is sourced from PubChem (CID 135048691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).