[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane

C14H26Si — CID 14177303

IUPAC[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane
SMILESCC(C)=CCC/C(C)=C/C=C/[Si](C)(C)C
InChIInChI=1S/C14H26Si/c1-13(2)9-7-10-14(3)11-8-12-15(4,5)6/h8-9,11-12H,7,10H2,1-6H3/b12-8+,14-11+
InChIKeySREDMVZVDGSXQD-ZZAMHKPASA-N
MW222.45 g/mol
LogP5.11
Rot. Bonds5

About [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane

[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane (PubChem CID 14177303) has the molecular formula C14H26Si and a molecular weight of 222.45 g/mol. Its IUPAC name is [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane.

Molecular Properties

Compound Name[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane
PubChem CID14177303
Molecular FormulaC14H26Si
Molecular Weight222.45 g/mol
Exact Mass222.18
IUPAC Name[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane
SMILESCC(C)=CCC/C(C)=C/C=C/[Si](C)(C)C
InChIInChI=1S/C14H26Si/c1-13(2)9-7-10-14(3)11-8-12-15(4,5)6/h8-9,11-12H,7,10H2,1-6H3/b12-8+,14-11+
InChIKeySREDMVZVDGSXQD-ZZAMHKPASA-N
XLogP5.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500222.45
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane?
The IUPAC name of [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane (CID 14177303) is [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane.
What is the SMILES notation for [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane?
The canonical SMILES for [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane is CC(C)=CCC/C(C)=C/C=C/[Si](C)(C)C.
What is the InChIKey of [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane?
The InChIKey is SREDMVZVDGSXQD-ZZAMHKPASA-N. The full InChI is InChI=1S/C14H26Si/c1-13(2)9-7-10-14(3)11-8-12-15(4,5)6/h8-9,11-12H,7,10H2,1-6H3/b12-8+,14-11+.
What are the key properties of [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane?
[(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane has a molecular weight of 222.45 g/mol, XLogP of 5.11, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E,3E)-4,8-dimethylnona-1,3,7-trienyl]-trimethylsilane is sourced from PubChem (CID 14177303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).