(8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane

C15H30OSi — CID 71351072

IUPAC(8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane
SMILESCOC=CCC(C)(C)CC=C(C)C[Si](C)(C)C
InChIInChI=1S/C15H30OSi/c1-14(13-17(5,6)7)9-11-15(2,3)10-8-12-16-4/h8-9,12H,10-11,13H2,1-7H3
InChIKeySBTVRIUQNHYZRA-UHFFFAOYSA-N
MW254.49 g/mol
LogP5.24
Rot. Bonds7

About (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane

(8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane (PubChem CID 71351072) has the molecular formula C15H30OSi and a molecular weight of 254.49 g/mol. Its IUPAC name is (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane.

Molecular Properties

Compound Name(8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane
PubChem CID71351072
Molecular FormulaC15H30OSi
Molecular Weight254.49 g/mol
Exact Mass254.21
IUPAC Name(8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane
SMILESCOC=CCC(C)(C)CC=C(C)C[Si](C)(C)C
InChIInChI=1S/C15H30OSi/c1-14(13-17(5,6)7)9-11-15(2,3)10-8-12-16-4/h8-9,12H,10-11,13H2,1-7H3
InChIKeySBTVRIUQNHYZRA-UHFFFAOYSA-N
XLogP5.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.49
LogP ≤ 55.24
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane?
The IUPAC name of (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane (CID 71351072) is (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane.
What is the SMILES notation for (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane?
The canonical SMILES for (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane is COC=CCC(C)(C)CC=C(C)C[Si](C)(C)C.
What is the InChIKey of (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane?
The InChIKey is SBTVRIUQNHYZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30OSi/c1-14(13-17(5,6)7)9-11-15(2,3)10-8-12-16-4/h8-9,12H,10-11,13H2,1-7H3.
What are the key properties of (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane?
(8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane has a molecular weight of 254.49 g/mol, XLogP of 5.24, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methoxy-2,5,5-trimethylocta-2,7-dienyl)-trimethylsilane is sourced from PubChem (CID 71351072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).