[(1E)-cycloocten-1-yl]-trimethoxysilane

C11H22O3Si — CID 22623529

IUPAC[(1E)-cycloocten-1-yl]-trimethoxysilane
SMILESCO[Si](OC)(OC)/C1=C/CCCCCC1
InChIInChI=1S/C11H22O3Si/c1-12-15(13-2,14-3)11-9-7-5-4-6-8-10-11/h9H,4-8,10H2,1-3H3/b11-9+
InChIKeyOKVXUYRRMFSIGL-PKNBQFBNSA-N
MW230.38 g/mol
LogP2.68
Rot. Bonds4

About [(1E)-cycloocten-1-yl]-trimethoxysilane

[(1E)-cycloocten-1-yl]-trimethoxysilane (PubChem CID 22623529) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is [(1E)-cycloocten-1-yl]-trimethoxysilane.

Molecular Properties

Compound Name[(1E)-cycloocten-1-yl]-trimethoxysilane
PubChem CID22623529
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Name[(1E)-cycloocten-1-yl]-trimethoxysilane
SMILESCO[Si](OC)(OC)/C1=C/CCCCCC1
InChIInChI=1S/C11H22O3Si/c1-12-15(13-2,14-3)11-9-7-5-4-6-8-10-11/h9H,4-8,10H2,1-3H3/b11-9+
InChIKeyOKVXUYRRMFSIGL-PKNBQFBNSA-N
XLogP2.68
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(1E)-cycloocten-1-yl]-trimethoxysilane?
The IUPAC name of [(1E)-cycloocten-1-yl]-trimethoxysilane (CID 22623529) is [(1E)-cycloocten-1-yl]-trimethoxysilane.
What is the SMILES notation for [(1E)-cycloocten-1-yl]-trimethoxysilane?
The canonical SMILES for [(1E)-cycloocten-1-yl]-trimethoxysilane is CO[Si](OC)(OC)/C1=C/CCCCCC1.
What is the InChIKey of [(1E)-cycloocten-1-yl]-trimethoxysilane?
The InChIKey is OKVXUYRRMFSIGL-PKNBQFBNSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-12-15(13-2,14-3)11-9-7-5-4-6-8-10-11/h9H,4-8,10H2,1-3H3/b11-9+.
What are the key properties of [(1E)-cycloocten-1-yl]-trimethoxysilane?
[(1E)-cycloocten-1-yl]-trimethoxysilane has a molecular weight of 230.38 g/mol, XLogP of 2.68, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1E)-cycloocten-1-yl]-trimethoxysilane is sourced from PubChem (CID 22623529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).