triethyl(4-methylpenta-1,2,3-trienyl)silane

C12H22Si — CID 12730930

IUPACtriethyl(4-methylpenta-1,2,3-trienyl)silane
SMILESCC[Si](C=C=C=C(C)C)(CC)CC
InChIInChI=1S/C12H22Si/c1-6-13(7-2,8-3)11-9-10-12(4)5/h11H,6-8H2,1-5H3
InChIKeyWRBWEHAPDUQMGD-UHFFFAOYSA-N
MW194.39 g/mol
LogP4.31
Rot. Bonds4

About triethyl(4-methylpenta-1,2,3-trienyl)silane

triethyl(4-methylpenta-1,2,3-trienyl)silane (PubChem CID 12730930) has the molecular formula C12H22Si and a molecular weight of 194.39 g/mol. Its IUPAC name is triethyl(4-methylpenta-1,2,3-trienyl)silane.

Molecular Properties

Compound Nametriethyl(4-methylpenta-1,2,3-trienyl)silane
PubChem CID12730930
Molecular FormulaC12H22Si
Molecular Weight194.39 g/mol
Exact Mass194.15
IUPAC Nametriethyl(4-methylpenta-1,2,3-trienyl)silane
SMILESCC[Si](C=C=C=C(C)C)(CC)CC
InChIInChI=1S/C12H22Si/c1-6-13(7-2,8-3)11-9-10-12(4)5/h11H,6-8H2,1-5H3
InChIKeyWRBWEHAPDUQMGD-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.39
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 triethyl(4-methylpenta-1,2,3-trienyl)silane?
The IUPAC name of triethyl(4-methylpenta-1,2,3-trienyl)silane (CID 12730930) is triethyl(4-methylpenta-1,2,3-trienyl)silane.
What is the SMILES notation for triethyl(4-methylpenta-1,2,3-trienyl)silane?
The canonical SMILES for triethyl(4-methylpenta-1,2,3-trienyl)silane is CC[Si](C=C=C=C(C)C)(CC)CC.
What is the InChIKey of triethyl(4-methylpenta-1,2,3-trienyl)silane?
The InChIKey is WRBWEHAPDUQMGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22Si/c1-6-13(7-2,8-3)11-9-10-12(4)5/h11H,6-8H2,1-5H3.
What are the key properties of triethyl(4-methylpenta-1,2,3-trienyl)silane?
triethyl(4-methylpenta-1,2,3-trienyl)silane has a molecular weight of 194.39 g/mol, XLogP of 4.31, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(4-methylpenta-1,2,3-trienyl)silane is sourced from PubChem (CID 12730930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).