triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane

C11H22O2Si — CID 11298858

IUPACtriethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane
SMILESC=C(/C=C/OC)O[Si](CC)(CC)CC
InChIInChI=1S/C11H22O2Si/c1-6-14(7-2,8-3)13-11(4)9-10-12-5/h9-10H,4,6-8H2,1-3,5H3/b10-9+
InChIKeyADYVVBOGUKIQSY-MDZDMXLPSA-N
MW214.38 g/mol
LogP3.68
Rot. Bonds7

About triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane

triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane (PubChem CID 11298858) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane
PubChem CID11298858
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Nametriethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane
SMILESC=C(/C=C/OC)O[Si](CC)(CC)CC
InChIInChI=1S/C11H22O2Si/c1-6-14(7-2,8-3)13-11(4)9-10-12-5/h9-10H,4,6-8H2,1-3,5H3/b10-9+
InChIKeyADYVVBOGUKIQSY-MDZDMXLPSA-N
XLogP3.68
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane?
The IUPAC name of triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane (CID 11298858) is triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane.
What is the SMILES notation for triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane?
The canonical SMILES for triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane is C=C(/C=C/OC)O[Si](CC)(CC)CC.
What is the InChIKey of triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane?
The InChIKey is ADYVVBOGUKIQSY-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-6-14(7-2,8-3)13-11(4)9-10-12-5/h9-10H,4,6-8H2,1-3,5H3/b10-9+.
What are the key properties of triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane?
triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane has a molecular weight of 214.38 g/mol, XLogP of 3.68, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(3E)-4-methoxybuta-1,3-dien-2-yl]oxysilane is sourced from PubChem (CID 11298858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).