butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane

C28H54O3Si2 — CID 141248696

IUPACbutoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane
SMILESCCCCO[Si](O[Si](OCCCC)(C1CCCC1)C1CCCC1)(C1CCCC1)C1CCCC1
InChIInChI=1S/C28H54O3Si2/c1-3-5-23-29-32(25-15-7-8-16-25,26-17-9-10-18-26)31-33(30-24-6-4-2,27-19-11-12-20-27)28-21-13-14-22-28/h25-28H,3-24H2,1-2H3
InChIKeyZKCFTHSWLDCDGR-UHFFFAOYSA-N
MW494.91 g/mol
LogP9.30
Rot. Bonds14

About butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane

butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane (PubChem CID 141248696) has the molecular formula C28H54O3Si2 and a molecular weight of 494.91 g/mol. Its IUPAC name is butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane.

Molecular Properties

Compound Namebutoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane
PubChem CID141248696
Molecular FormulaC28H54O3Si2
Molecular Weight494.91 g/mol
Exact Mass494.36
IUPAC Namebutoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane
SMILESCCCCO[Si](O[Si](OCCCC)(C1CCCC1)C1CCCC1)(C1CCCC1)C1CCCC1
InChIInChI=1S/C28H54O3Si2/c1-3-5-23-29-32(25-15-7-8-16-25,26-17-9-10-18-26)31-33(30-24-6-4-2,27-19-11-12-20-27)28-21-13-14-22-28/h25-28H,3-24H2,1-2H3
InChIKeyZKCFTHSWLDCDGR-UHFFFAOYSA-N
XLogP9.30
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500494.91
LogP ≤ 59.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane 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

tributoxy(cyclopropyl)silane
CID 139991761
cyclononyl-cyclopropyl-diethoxysilane
CID 139768397
cyclohexyl(trimethoxy)silane;tributoxy(ethenyl)silane
CID 160917437
bis(4-methylcyclohexyl)-dipropoxysilane
CID 139675628
1,2-dibutoxycyclohexane
CID 24962665
N-[cyclohexyl(dipropoxy)silyl]butan-1-amine;N-[cyclopentyl(dipropoxy)silyl]butan-1-amine
CID 68954702
cycloheptyl-hydroxy-dipropoxysilane
CID 57088742
dibutoxy-[dibutoxy(ethyl)silyl]oxy-ethylsilane
CID 545962
cyclohexyl-(iodomethyl)-dipropoxysilane
CID 23146620
dicyclohexyl-bis(propoxymethyl)silane
CID 166518819
cyclopentylcyclopentane;dibutoxysilane
CID 174737860
dicyclopentyl-heptyl-methylsilane
CID 162290735

Frequently Asked Questions

What is the IUPAC name of butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane?
The IUPAC name of butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane (CID 141248696) is butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane.
What is the SMILES notation for butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane?
The canonical SMILES for butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane is CCCCO[Si](O[Si](OCCCC)(C1CCCC1)C1CCCC1)(C1CCCC1)C1CCCC1.
What is the InChIKey of butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane?
The InChIKey is ZKCFTHSWLDCDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H54O3Si2/c1-3-5-23-29-32(25-15-7-8-16-25,26-17-9-10-18-26)31-33(30-24-6-4-2,27-19-11-12-20-27)28-21-13-14-22-28/h25-28H,3-24H2,1-2H3.
What are the key properties of butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane?
butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane has a molecular weight of 494.91 g/mol, XLogP of 9.30, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-[butoxy(dicyclopentyl)silyl]oxy-dicyclopentylsilane is sourced from PubChem (CID 141248696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).