ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane

C13H18O3Si — CID 164901070

IUPACethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane
SMILESCCO[Si](C)(C)c1oc2ccccc2c1OC
InChIInChI=1S/C13H18O3Si/c1-5-15-17(3,4)13-12(14-2)10-8-6-7-9-11(10)16-13/h6-9H,5H2,1-4H3
InChIKeyDZEOPRMZNQUNSD-UHFFFAOYSA-N
MW250.37 g/mol
LogP2.89
Rot. Bonds4

About ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane

ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane (PubChem CID 164901070) has the molecular formula C13H18O3Si and a molecular weight of 250.37 g/mol. Its IUPAC name is ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane.

Molecular Properties

Compound Nameethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane
PubChem CID164901070
Molecular FormulaC13H18O3Si
Molecular Weight250.37 g/mol
Exact Mass250.10
IUPAC Nameethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane
SMILESCCO[Si](C)(C)c1oc2ccccc2c1OC
InChIInChI=1S/C13H18O3Si/c1-5-15-17(3,4)13-12(14-2)10-8-6-7-9-11(10)16-13/h6-9H,5H2,1-4H3
InChIKeyDZEOPRMZNQUNSD-UHFFFAOYSA-N
XLogP2.89
TPSA31.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 52.89
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 ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane?
The IUPAC name of ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane (CID 164901070) is ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane.
What is the SMILES notation for ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane?
The canonical SMILES for ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane is CCO[Si](C)(C)c1oc2ccccc2c1OC.
What is the InChIKey of ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane?
The InChIKey is DZEOPRMZNQUNSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18O3Si/c1-5-15-17(3,4)13-12(14-2)10-8-6-7-9-11(10)16-13/h6-9H,5H2,1-4H3.
What are the key properties of ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane?
ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane has a molecular weight of 250.37 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-(3-methoxy-1-benzofuran-2-yl)-dimethylsilane is sourced from PubChem (CID 164901070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).