8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane

C18H42O4Si2 — CID 87498284

IUPAC8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane
SMILESCCC[Si](CCCCCCCC[Si](CCC)(OC)OC)(OC)OC
InChIInChI=1S/C18H42O4Si2/c1-7-15-23(19-3,20-4)17-13-11-9-10-12-14-18-24(21-5,22-6)16-8-2/h7-18H2,1-6H3
InChIKeyHNDBRYMXQWBVOH-UHFFFAOYSA-N
MW378.70 g/mol
LogP5.62
Rot. Bonds17

About 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane

8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane (PubChem CID 87498284) has the molecular formula C18H42O4Si2 and a molecular weight of 378.70 g/mol. Its IUPAC name is 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane.

Molecular Properties

Compound Name8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane
PubChem CID87498284
Molecular FormulaC18H42O4Si2
Molecular Weight378.70 g/mol
Exact Mass378.26
IUPAC Name8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane
SMILESCCC[Si](CCCCCCCC[Si](CCC)(OC)OC)(OC)OC
InChIInChI=1S/C18H42O4Si2/c1-7-15-23(19-3,20-4)17-13-11-9-10-12-14-18-24(21-5,22-6)16-8-2/h7-18H2,1-6H3
InChIKeyHNDBRYMXQWBVOH-UHFFFAOYSA-N
XLogP5.62
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.70
LogP ≤ 55.62
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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Frequently Asked Questions

What is the IUPAC name of 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane?
The IUPAC name of 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane (CID 87498284) is 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane.
What is the SMILES notation for 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane?
The canonical SMILES for 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane is CCC[Si](CCCCCCCC[Si](CCC)(OC)OC)(OC)OC.
What is the InChIKey of 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane?
The InChIKey is HNDBRYMXQWBVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42O4Si2/c1-7-15-23(19-3,20-4)17-13-11-9-10-12-14-18-24(21-5,22-6)16-8-2/h7-18H2,1-6H3.
What are the key properties of 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane?
8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane has a molecular weight of 378.70 g/mol, XLogP of 5.62, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[dimethoxy(propyl)silyl]octyl-dimethoxy-propylsilane is sourced from PubChem (CID 87498284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).