3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane

C13H26O2Si — CID 139909179

IUPAC3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane
SMILESC=C(O[Si](C)(C)C)C(=COC)CCCCC
InChIInChI=1S/C13H26O2Si/c1-7-8-9-10-13(11-14-3)12(2)15-16(4,5)6/h11H,2,7-10H2,1,3-6H3
InChIKeyZMFJEFBYRSSAKU-UHFFFAOYSA-N
MW242.43 g/mol
LogP4.46
Rot. Bonds8

About 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane

3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane (PubChem CID 139909179) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane.

Molecular Properties

Compound Name3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane
PubChem CID139909179
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane
SMILESC=C(O[Si](C)(C)C)C(=COC)CCCCC
InChIInChI=1S/C13H26O2Si/c1-7-8-9-10-13(11-14-3)12(2)15-16(4,5)6/h11H,2,7-10H2,1,3-6H3
InChIKeyZMFJEFBYRSSAKU-UHFFFAOYSA-N
XLogP4.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane?
The IUPAC name of 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane (CID 139909179) is 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane.
What is the SMILES notation for 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane?
The canonical SMILES for 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane is C=C(O[Si](C)(C)C)C(=COC)CCCCC.
What is the InChIKey of 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane?
The InChIKey is ZMFJEFBYRSSAKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-7-8-9-10-13(11-14-3)12(2)15-16(4,5)6/h11H,2,7-10H2,1,3-6H3.
What are the key properties of 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane?
3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane has a molecular weight of 242.43 g/mol, XLogP of 4.46, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethylidene)oct-1-en-2-yloxy-trimethylsilane is sourced from PubChem (CID 139909179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).