triethoxy(octa-5,7-dien-2-yl)silane

C14H28O3Si — CID 87891599

IUPACtriethoxy(octa-5,7-dien-2-yl)silane
SMILESC=CC=CCCC(C)[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-6-10-11-12-13-14(5)18(15-7-2,16-8-3)17-9-4/h6,10-11,14H,1,7-9,12-13H2,2-5H3
InChIKeyQSSJQUATAFJARU-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.95
Rot. Bonds11

About triethoxy(octa-5,7-dien-2-yl)silane

triethoxy(octa-5,7-dien-2-yl)silane (PubChem CID 87891599) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is triethoxy(octa-5,7-dien-2-yl)silane.

Molecular Properties

Compound Nametriethoxy(octa-5,7-dien-2-yl)silane
PubChem CID87891599
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Nametriethoxy(octa-5,7-dien-2-yl)silane
SMILESC=CC=CCCC(C)[Si](OCC)(OCC)OCC
InChIInChI=1S/C14H28O3Si/c1-6-10-11-12-13-14(5)18(15-7-2,16-8-3)17-9-4/h6,10-11,14H,1,7-9,12-13H2,2-5H3
InChIKeyQSSJQUATAFJARU-UHFFFAOYSA-N
XLogP3.95
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(3Z)-7,7-diethoxyhepta-1,3-diene
CID 163205336
bis((3E)-octa-1,3-diene);ruthenium
CID 173228817
7-octa-5,7-dien-2-ylsulfanylocta-1,3-diene
CID 154245049
[(3E)-hexa-3,5-dienoxy]-tri(propan-2-yl)silane
CID 10531152
(6E)-2-methylnona-6,8-dien-3-ol
CID 14545535
triethoxy(5-methyloct-6-en-2-yl)silane
CID 123528408
(7E)-deca-7,9-dien-4-ol
CID 46176590
(3Z)-hepta-1,3-diene
CID 6427773
hex-5-en-2-yl(trimethoxy)silane
CID 22907711
diethoxy-hept-5-en-2-yl-propylsilane
CID 150905380
4-triethoxysilylpentyl 2-methylprop-2-enoate
CID 87402271
(3E,7E)-9-methyldeca-1,3,7-triene
CID 101414428

Frequently Asked Questions

What is the IUPAC name of triethoxy(octa-5,7-dien-2-yl)silane?
The IUPAC name of triethoxy(octa-5,7-dien-2-yl)silane (CID 87891599) is triethoxy(octa-5,7-dien-2-yl)silane.
What is the SMILES notation for triethoxy(octa-5,7-dien-2-yl)silane?
The canonical SMILES for triethoxy(octa-5,7-dien-2-yl)silane is C=CC=CCCC(C)[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy(octa-5,7-dien-2-yl)silane?
The InChIKey is QSSJQUATAFJARU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-6-10-11-12-13-14(5)18(15-7-2,16-8-3)17-9-4/h6,10-11,14H,1,7-9,12-13H2,2-5H3.
What are the key properties of triethoxy(octa-5,7-dien-2-yl)silane?
triethoxy(octa-5,7-dien-2-yl)silane has a molecular weight of 272.46 g/mol, XLogP of 3.95, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy(octa-5,7-dien-2-yl)silane is sourced from PubChem (CID 87891599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).