triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane

C14H30O4Si — CID 87064614

IUPACtriethoxy-[1-(2-methylprop-2-enoxy)butyl]silane
SMILESC=C(C)COC(CCC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H30O4Si/c1-7-11-14(15-12-13(5)6)19(16-8-2,17-9-3)18-10-4/h14H,5,7-12H2,1-4,6H3
InChIKeyMHJLWQSDWQASAZ-UHFFFAOYSA-N
MW290.48 g/mol
LogP3.34
Rot. Bonds12

About triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane

triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane (PubChem CID 87064614) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane.

Molecular Properties

Compound Nametriethoxy-[1-(2-methylprop-2-enoxy)butyl]silane
PubChem CID87064614
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Nametriethoxy-[1-(2-methylprop-2-enoxy)butyl]silane
SMILESC=C(C)COC(CCC)[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H30O4Si/c1-7-11-14(15-12-13(5)6)19(16-8-2,17-9-3)18-10-4/h14H,5,7-12H2,1-4,6H3
InChIKeyMHJLWQSDWQASAZ-UHFFFAOYSA-N
XLogP3.34
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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 triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane?
The IUPAC name of triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane (CID 87064614) is triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane.
What is the SMILES notation for triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane?
The canonical SMILES for triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane is C=C(C)COC(CCC)[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane?
The InChIKey is MHJLWQSDWQASAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-7-11-14(15-12-13(5)6)19(16-8-2,17-9-3)18-10-4/h14H,5,7-12H2,1-4,6H3.
What are the key properties of triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane?
triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane has a molecular weight of 290.48 g/mol, XLogP of 3.34, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[1-(2-methylprop-2-enoxy)butyl]silane is sourced from PubChem (CID 87064614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).