3-dipentoxysilylpropyl(dipentoxy)silane

C23H52O4Si2 — CID 123859896

IUPAC3-dipentoxysilylpropyl(dipentoxy)silane
SMILESCCCCCO[SiH](CCC[SiH](OCCCCC)OCCCCC)OCCCCC
InChIInChI=1S/C23H52O4Si2/c1-5-9-13-18-24-28(25-19-14-10-6-2)22-17-23-29(26-20-15-11-7-3)27-21-16-12-8-4/h28-29H,5-23H2,1-4H3
InChIKeyCQBUNPFPUCFHDA-UHFFFAOYSA-N
MW448.84 g/mol
LogP6.64
Rot. Bonds24

About 3-dipentoxysilylpropyl(dipentoxy)silane

3-dipentoxysilylpropyl(dipentoxy)silane (PubChem CID 123859896) has the molecular formula C23H52O4Si2 and a molecular weight of 448.84 g/mol. Its IUPAC name is 3-dipentoxysilylpropyl(dipentoxy)silane.

Molecular Properties

Compound Name3-dipentoxysilylpropyl(dipentoxy)silane
PubChem CID123859896
Molecular FormulaC23H52O4Si2
Molecular Weight448.84 g/mol
Exact Mass448.34
IUPAC Name3-dipentoxysilylpropyl(dipentoxy)silane
SMILESCCCCCO[SiH](CCC[SiH](OCCCCC)OCCCCC)OCCCCC
InChIInChI=1S/C23H52O4Si2/c1-5-9-13-18-24-28(25-19-14-10-6-2)22-17-23-29(26-20-15-11-7-3)27-21-16-12-8-4/h28-29H,5-23H2,1-4H3
InChIKeyCQBUNPFPUCFHDA-UHFFFAOYSA-N
XLogP6.64
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds24
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.84
LogP ≤ 56.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dibutoxy(3-dibutoxysilylpropyl)silane
CID 123992864
dipentoxy(propyl)silane
CID 123345702
but-3-enyl(dipentoxy)silane
CID 172689887
butoxy-butyl-methoxysilane
CID 154072668
diethoxy(tetracosyl)silane
CID 151502912
isocyanic acid;pentyl(dipropoxy)silane
CID 172700048
tri(undecoxy)silane
CID 123875078
dibutyl(tetradecoxy)silane
CID 175185035
3-chloropropyl(dipropoxy)silane
CID 123436656
chloro(dihexoxy)silane
CID 154357629
didodecoxy(hydroxy)silane
CID 173157233
1-dodecoxyhexadecane
CID 22256973

Frequently Asked Questions

What is the IUPAC name of 3-dipentoxysilylpropyl(dipentoxy)silane?
The IUPAC name of 3-dipentoxysilylpropyl(dipentoxy)silane (CID 123859896) is 3-dipentoxysilylpropyl(dipentoxy)silane.
What is the SMILES notation for 3-dipentoxysilylpropyl(dipentoxy)silane?
The canonical SMILES for 3-dipentoxysilylpropyl(dipentoxy)silane is CCCCCO[SiH](CCC[SiH](OCCCCC)OCCCCC)OCCCCC.
What is the InChIKey of 3-dipentoxysilylpropyl(dipentoxy)silane?
The InChIKey is CQBUNPFPUCFHDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H52O4Si2/c1-5-9-13-18-24-28(25-19-14-10-6-2)22-17-23-29(26-20-15-11-7-3)27-21-16-12-8-4/h28-29H,5-23H2,1-4H3.
What are the key properties of 3-dipentoxysilylpropyl(dipentoxy)silane?
3-dipentoxysilylpropyl(dipentoxy)silane has a molecular weight of 448.84 g/mol, XLogP of 6.64, 24 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dipentoxysilylpropyl(dipentoxy)silane is sourced from PubChem (CID 123859896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).