2-trimethylsilylethyl nona-2,3-dienoate

C14H26O2Si — CID 10491190

IUPAC2-trimethylsilylethyl nona-2,3-dienoate
SMILESCCCCCC=C=CC(=O)OCC[Si](C)(C)C
InChIInChI=1S/C14H26O2Si/c1-5-6-7-8-9-10-11-14(15)16-12-13-17(2,3)4/h9,11H,5-8,12-13H2,1-4H3
InChIKeyRYXULWBLAQGFEF-UHFFFAOYSA-N
MW254.45 g/mol
LogP4.16
Rot. Bonds8

About 2-trimethylsilylethyl nona-2,3-dienoate

2-trimethylsilylethyl nona-2,3-dienoate (PubChem CID 10491190) has the molecular formula C14H26O2Si and a molecular weight of 254.45 g/mol. Its IUPAC name is 2-trimethylsilylethyl nona-2,3-dienoate.

Molecular Properties

Compound Name2-trimethylsilylethyl nona-2,3-dienoate
PubChem CID10491190
Molecular FormulaC14H26O2Si
Molecular Weight254.45 g/mol
Exact Mass254.17
IUPAC Name2-trimethylsilylethyl nona-2,3-dienoate
SMILESCCCCCC=C=CC(=O)OCC[Si](C)(C)C
InChIInChI=1S/C14H26O2Si/c1-5-6-7-8-9-10-11-14(15)16-12-13-17(2,3)4/h9,11H,5-8,12-13H2,1-4H3
InChIKeyRYXULWBLAQGFEF-UHFFFAOYSA-N
XLogP4.16
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.45
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

Nona-2,3-dienoic acid, ethyl ester
CID 533672
Ethyl octa-2,3-dienoate
CID 15202653
Ethyl deca-2,3-dienoate
CID 13675401
8-[Tert-butyl(dimethyl)silyl]oxyocta-2,3-dienyl acetate
CID 46188086
Methyl 2-trimethylsilyltrideca-2,3-dienoate
CID 71578404
Ethyl 4-trimethylsilylbuta-2,3-dienoate
CID 85832774
ethyl (E)-2-trimethylsilylnon-2-enoate
CID 101514507
Methyl 2-trimethylsilylocta-2,3-dienoate
CID 102203798
[(E)-1-trimethylsilyloct-2-enyl] acetate
CID 135047835
ethyl (E)-2-triethylsilylhept-2-enoate
CID 135071025
3-[Dimethyl(6-methylhept-6-en-2-yl)silyl]propyl prop-2-enoate
CID 20631234
3-[Hexan-2-yl(dimethyl)silyl]propyl prop-2-enoate
CID 20631238

Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilylethyl nona-2,3-dienoate?
The IUPAC name of 2-trimethylsilylethyl nona-2,3-dienoate (CID 10491190) is 2-trimethylsilylethyl nona-2,3-dienoate.
What is the SMILES notation for 2-trimethylsilylethyl nona-2,3-dienoate?
The canonical SMILES for 2-trimethylsilylethyl nona-2,3-dienoate is CCCCCC=C=CC(=O)OCC[Si](C)(C)C.
What is the InChIKey of 2-trimethylsilylethyl nona-2,3-dienoate?
The InChIKey is RYXULWBLAQGFEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O2Si/c1-5-6-7-8-9-10-11-14(15)16-12-13-17(2,3)4/h9,11H,5-8,12-13H2,1-4H3.
What are the key properties of 2-trimethylsilylethyl nona-2,3-dienoate?
2-trimethylsilylethyl nona-2,3-dienoate has a molecular weight of 254.45 g/mol, XLogP of 4.16, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilylethyl nona-2,3-dienoate is sourced from PubChem (CID 10491190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).