ethoxy-dimethyl-pent-4-en-2-yloxysilane

C9H20O2Si — CID 87655810

IUPACethoxy-dimethyl-pent-4-en-2-yloxysilane
SMILESC=CCC(C)O[Si](C)(C)OCC
InChIInChI=1S/C9H20O2Si/c1-6-8-9(3)11-12(4,5)10-7-2/h6,9H,1,7-8H2,2-5H3
InChIKeyIGGGXJPUWKUVDI-UHFFFAOYSA-N
MW188.34 g/mol
LogP2.71
Rot. Bonds6

About ethoxy-dimethyl-pent-4-en-2-yloxysilane

ethoxy-dimethyl-pent-4-en-2-yloxysilane (PubChem CID 87655810) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is ethoxy-dimethyl-pent-4-en-2-yloxysilane.

Molecular Properties

Compound Nameethoxy-dimethyl-pent-4-en-2-yloxysilane
PubChem CID87655810
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Nameethoxy-dimethyl-pent-4-en-2-yloxysilane
SMILESC=CCC(C)O[Si](C)(C)OCC
InChIInChI=1S/C9H20O2Si/c1-6-8-9(3)11-12(4,5)10-7-2/h6,9H,1,7-8H2,2-5H3
InChIKeyIGGGXJPUWKUVDI-UHFFFAOYSA-N
XLogP2.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 ethoxy-dimethyl-pent-4-en-2-yloxysilane?
The IUPAC name of ethoxy-dimethyl-pent-4-en-2-yloxysilane (CID 87655810) is ethoxy-dimethyl-pent-4-en-2-yloxysilane.
What is the SMILES notation for ethoxy-dimethyl-pent-4-en-2-yloxysilane?
The canonical SMILES for ethoxy-dimethyl-pent-4-en-2-yloxysilane is C=CCC(C)O[Si](C)(C)OCC.
What is the InChIKey of ethoxy-dimethyl-pent-4-en-2-yloxysilane?
The InChIKey is IGGGXJPUWKUVDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si/c1-6-8-9(3)11-12(4,5)10-7-2/h6,9H,1,7-8H2,2-5H3.
What are the key properties of ethoxy-dimethyl-pent-4-en-2-yloxysilane?
ethoxy-dimethyl-pent-4-en-2-yloxysilane has a molecular weight of 188.34 g/mol, XLogP of 2.71, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dimethyl-pent-4-en-2-yloxysilane is sourced from PubChem (CID 87655810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).