dibutoxy-prop-2-enyl-propoxysilane

C14H30O3Si — CID 87365152

IUPACdibutoxy-prop-2-enyl-propoxysilane
SMILESC=CC[Si](OCCC)(OCCCC)OCCCC
InChIInChI=1S/C14H30O3Si/c1-5-9-12-16-18(14-8-4,15-11-7-3)17-13-10-6-2/h8H,4-7,9-14H2,1-3H3
InChIKeyRCMCQUOTZIRWFN-UHFFFAOYSA-N
MW274.48 g/mol
LogP4.17
Rot. Bonds13

About dibutoxy-prop-2-enyl-propoxysilane

dibutoxy-prop-2-enyl-propoxysilane (PubChem CID 87365152) has the molecular formula C14H30O3Si and a molecular weight of 274.48 g/mol. Its IUPAC name is dibutoxy-prop-2-enyl-propoxysilane.

Molecular Properties

Compound Namedibutoxy-prop-2-enyl-propoxysilane
PubChem CID87365152
Molecular FormulaC14H30O3Si
Molecular Weight274.48 g/mol
Exact Mass274.20
IUPAC Namedibutoxy-prop-2-enyl-propoxysilane
SMILESC=CC[Si](OCCC)(OCCCC)OCCCC
InChIInChI=1S/C14H30O3Si/c1-5-9-12-16-18(14-8-4,15-11-7-3)17-13-10-6-2/h8H,4-7,9-14H2,1-3H3
InChIKeyRCMCQUOTZIRWFN-UHFFFAOYSA-N
XLogP4.17
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.48
LogP ≤ 54.17
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dibutoxy-prop-2-enyl-propoxysilane?
The IUPAC name of dibutoxy-prop-2-enyl-propoxysilane (CID 87365152) is dibutoxy-prop-2-enyl-propoxysilane.
What is the SMILES notation for dibutoxy-prop-2-enyl-propoxysilane?
The canonical SMILES for dibutoxy-prop-2-enyl-propoxysilane is C=CC[Si](OCCC)(OCCCC)OCCCC.
What is the InChIKey of dibutoxy-prop-2-enyl-propoxysilane?
The InChIKey is RCMCQUOTZIRWFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O3Si/c1-5-9-12-16-18(14-8-4,15-11-7-3)17-13-10-6-2/h8H,4-7,9-14H2,1-3H3.
What are the key properties of dibutoxy-prop-2-enyl-propoxysilane?
dibutoxy-prop-2-enyl-propoxysilane has a molecular weight of 274.48 g/mol, XLogP of 4.17, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-prop-2-enyl-propoxysilane is sourced from PubChem (CID 87365152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).