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

C13H26OSi — CID 11160490

IUPACtriethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane
SMILESC=C(O[Si](CC)(CC)CC)/C(C)=C/CC
InChIInChI=1S/C13H26OSi/c1-7-11-12(5)13(6)14-15(8-2,9-3)10-4/h11H,6-10H2,1-5H3/b12-11+
InChIKeyAZXZNUCIWMVXMB-VAWYXSNFSA-N
MW226.44 g/mol
LogP4.88
Rot. Bonds7

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

triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane (PubChem CID 11160490) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane
PubChem CID11160490
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Nametriethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane
SMILESC=C(O[Si](CC)(CC)CC)/C(C)=C/CC
InChIInChI=1S/C13H26OSi/c1-7-11-12(5)13(6)14-15(8-2,9-3)10-4/h11H,6-10H2,1-5H3/b12-11+
InChIKeyAZXZNUCIWMVXMB-VAWYXSNFSA-N
XLogP4.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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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Related Compounds

2-Trimethylsiloxy-4-methyl-1,3-pentadiene
CID 11116500
Tert-butyldimethyl(4-methylpenta-1,3-dien-2-yloxy)silane
CID 10899947
Tert-butyl-dimethyl-(2-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 11064098
Tert-butyl-cyclohexa-1,5-dien-1-yloxy-dimethylsilane
CID 11042035
trimethyl-[(3E)-5-methylhexa-1,3-dien-2-yl]oxysilane
CID 11183042
Silane, trimethyl[(5-methyl-1,5-cyclohexadien-1-yl)oxy]-
CID 11229158
Cyclopenta-1,4-dien-1-yloxy(triethyl)silane
CID 11424142
Tert-butyl-dimethyl-(5-methylcyclohexa-1,5-dien-1-yl)oxysilane
CID 13499167
(3-Cyclopropylideneprop-1-en-2-yloxy)trimethylsilane
CID 15174784
2,5-Dihydro-2,2-diisopropyl-3-(prop-1-en-2-yl)-1,2-oxasilole
CID 59227484
trimethyl-[(2Z)-4-methylpenta-2,4-dien-2-yl]oxysilane
CID 12670635
(E)-trimethyl(3-methylpenta-1,3-dien-2-yloxy)silane
CID 13660030

Frequently Asked Questions

What is the IUPAC name of triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane?
The IUPAC name of triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane (CID 11160490) is triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane.
What is the SMILES notation for triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane?
The canonical SMILES for triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane is C=C(O[Si](CC)(CC)CC)/C(C)=C/CC.
What is the InChIKey of triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane?
The InChIKey is AZXZNUCIWMVXMB-VAWYXSNFSA-N. The full InChI is InChI=1S/C13H26OSi/c1-7-11-12(5)13(6)14-15(8-2,9-3)10-4/h11H,6-10H2,1-5H3/b12-11+.
What are the key properties of triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane?
triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane has a molecular weight of 226.44 g/mol, XLogP of 4.88, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(3E)-3-methylhexa-1,3-dien-2-yl]oxysilane is sourced from PubChem (CID 11160490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).