oxan-2-yl(tripropoxy)silane

C14H30O4Si — CID 57156931

IUPACoxan-2-yl(tripropoxy)silane
SMILESCCCO[Si](OCCC)(OCCC)C1CCCCO1
InChIInChI=1S/C14H30O4Si/c1-4-10-16-19(17-11-5-2,18-12-6-3)14-9-7-8-13-15-14/h14H,4-13H2,1-3H3
InChIKeyOBACTHIIMSSMDE-UHFFFAOYSA-N
MW290.48 g/mol
LogP3.31
Rot. Bonds10

About oxan-2-yl(tripropoxy)silane

oxan-2-yl(tripropoxy)silane (PubChem CID 57156931) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is oxan-2-yl(tripropoxy)silane.

Molecular Properties

Compound Nameoxan-2-yl(tripropoxy)silane
PubChem CID57156931
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Nameoxan-2-yl(tripropoxy)silane
SMILESCCCO[Si](OCCC)(OCCC)C1CCCCO1
InChIInChI=1S/C14H30O4Si/c1-4-10-16-19(17-11-5-2,18-12-6-3)14-9-7-8-13-15-14/h14H,4-13H2,1-3H3
InChIKeyOBACTHIIMSSMDE-UHFFFAOYSA-N
XLogP3.31
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 oxan-2-yl(tripropoxy)silane?
The IUPAC name of oxan-2-yl(tripropoxy)silane (CID 57156931) is oxan-2-yl(tripropoxy)silane.
What is the SMILES notation for oxan-2-yl(tripropoxy)silane?
The canonical SMILES for oxan-2-yl(tripropoxy)silane is CCCO[Si](OCCC)(OCCC)C1CCCCO1.
What is the InChIKey of oxan-2-yl(tripropoxy)silane?
The InChIKey is OBACTHIIMSSMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-4-10-16-19(17-11-5-2,18-12-6-3)14-9-7-8-13-15-14/h14H,4-13H2,1-3H3.
What are the key properties of oxan-2-yl(tripropoxy)silane?
oxan-2-yl(tripropoxy)silane has a molecular weight of 290.48 g/mol, XLogP of 3.31, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-2-yl(tripropoxy)silane is sourced from PubChem (CID 57156931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).