triethyl(3-methylbuta-1,3-dien-2-yl)silane

C11H22Si — CID 19995268

IUPACtriethyl(3-methylbuta-1,3-dien-2-yl)silane
SMILESC=C(C)C(=C)[Si](CC)(CC)CC
InChIInChI=1S/C11H22Si/c1-7-12(8-2,9-3)11(6)10(4)5/h4,6-9H2,1-3,5H3
InChIKeyLLUNXPNZRWGGJO-UHFFFAOYSA-N
MW182.38 g/mol
LogP4.17
Rot. Bonds5

About triethyl(3-methylbuta-1,3-dien-2-yl)silane

triethyl(3-methylbuta-1,3-dien-2-yl)silane (PubChem CID 19995268) has the molecular formula C11H22Si and a molecular weight of 182.38 g/mol. Its IUPAC name is triethyl(3-methylbuta-1,3-dien-2-yl)silane.

Molecular Properties

Compound Nametriethyl(3-methylbuta-1,3-dien-2-yl)silane
PubChem CID19995268
Molecular FormulaC11H22Si
Molecular Weight182.38 g/mol
Exact Mass182.15
IUPAC Nametriethyl(3-methylbuta-1,3-dien-2-yl)silane
SMILESC=C(C)C(=C)[Si](CC)(CC)CC
InChIInChI=1S/C11H22Si/c1-7-12(8-2,9-3)11(6)10(4)5/h4,6-9H2,1-3,5H3
InChIKeyLLUNXPNZRWGGJO-UHFFFAOYSA-N
XLogP4.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.38
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl(3-methylbuta-1,3-dien-2-yl)silane?
The IUPAC name of triethyl(3-methylbuta-1,3-dien-2-yl)silane (CID 19995268) is triethyl(3-methylbuta-1,3-dien-2-yl)silane.
What is the SMILES notation for triethyl(3-methylbuta-1,3-dien-2-yl)silane?
The canonical SMILES for triethyl(3-methylbuta-1,3-dien-2-yl)silane is C=C(C)C(=C)[Si](CC)(CC)CC.
What is the InChIKey of triethyl(3-methylbuta-1,3-dien-2-yl)silane?
The InChIKey is LLUNXPNZRWGGJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22Si/c1-7-12(8-2,9-3)11(6)10(4)5/h4,6-9H2,1-3,5H3.
What are the key properties of triethyl(3-methylbuta-1,3-dien-2-yl)silane?
triethyl(3-methylbuta-1,3-dien-2-yl)silane has a molecular weight of 182.38 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(3-methylbuta-1,3-dien-2-yl)silane is sourced from PubChem (CID 19995268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).