ethyl(tripropoxy)silane;triethoxy(propyl)silane

C20H48O6Si2 — CID 19799420

IUPACethyl(tripropoxy)silane;triethoxy(propyl)silane
SMILESCCCO[Si](CC)(OCCC)OCCC.CCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H26O3Si.C9H22O3Si/c1-5-9-12-15(8-4,13-10-6-2)14-11-7-3;1-5-9-13(10-6-2,11-7-3)12-8-4/h5-11H2,1-4H3;5-9H2,1-4H3
InChIKeyNVBSOWDXOXFZGH-UHFFFAOYSA-N
MW440.77 g/mol
LogP5.67
Rot. Bonds18

About ethyl(tripropoxy)silane;triethoxy(propyl)silane

ethyl(tripropoxy)silane;triethoxy(propyl)silane (PubChem CID 19799420) has the molecular formula C20H48O6Si2 and a molecular weight of 440.77 g/mol. Its IUPAC name is ethyl(tripropoxy)silane;triethoxy(propyl)silane.

Molecular Properties

Compound Nameethyl(tripropoxy)silane;triethoxy(propyl)silane
PubChem CID19799420
Molecular FormulaC20H48O6Si2
Molecular Weight440.77 g/mol
Exact Mass440.30
IUPAC Nameethyl(tripropoxy)silane;triethoxy(propyl)silane
SMILESCCCO[Si](CC)(OCCC)OCCC.CCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C11H26O3Si.C9H22O3Si/c1-5-9-12-15(8-4,13-10-6-2)14-11-7-3;1-5-9-13(10-6-2,11-7-3)12-8-4/h5-11H2,1-4H3;5-9H2,1-4H3
InChIKeyNVBSOWDXOXFZGH-UHFFFAOYSA-N
XLogP5.67
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms28
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.77
LogP ≤ 55.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethyl(tripropoxy)silane;triethoxy(propyl)silane?
The IUPAC name of ethyl(tripropoxy)silane;triethoxy(propyl)silane (CID 19799420) is ethyl(tripropoxy)silane;triethoxy(propyl)silane.
What is the SMILES notation for ethyl(tripropoxy)silane;triethoxy(propyl)silane?
The canonical SMILES for ethyl(tripropoxy)silane;triethoxy(propyl)silane is CCCO[Si](CC)(OCCC)OCCC.CCC[Si](OCC)(OCC)OCC.
What is the InChIKey of ethyl(tripropoxy)silane;triethoxy(propyl)silane?
The InChIKey is NVBSOWDXOXFZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O3Si.C9H22O3Si/c1-5-9-12-15(8-4,13-10-6-2)14-11-7-3;1-5-9-13(10-6-2,11-7-3)12-8-4/h5-11H2,1-4H3;5-9H2,1-4H3.
What are the key properties of ethyl(tripropoxy)silane;triethoxy(propyl)silane?
ethyl(tripropoxy)silane;triethoxy(propyl)silane has a molecular weight of 440.77 g/mol, XLogP of 5.67, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(tripropoxy)silane;triethoxy(propyl)silane is sourced from PubChem (CID 19799420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).