(2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane

C15H20O2Si — CID 177454044

IUPAC(2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane
SMILESC=Cc1oc2c(OC)cccc2c1C[Si](C)(C)C
InChIInChI=1S/C15H20O2Si/c1-6-13-12(10-18(3,4)5)11-8-7-9-14(16-2)15(11)17-13/h6-9H,1,10H2,2-5H3
InChIKeyWGWHXVLLNXLNGT-UHFFFAOYSA-N
MW260.41 g/mol
LogP4.50
Rot. Bonds4

About (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane

(2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane (PubChem CID 177454044) has the molecular formula C15H20O2Si and a molecular weight of 260.41 g/mol. Its IUPAC name is (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane.

Molecular Properties

Compound Name(2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane
PubChem CID177454044
Molecular FormulaC15H20O2Si
Molecular Weight260.41 g/mol
Exact Mass260.12
IUPAC Name(2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane
SMILESC=Cc1oc2c(OC)cccc2c1C[Si](C)(C)C
InChIInChI=1S/C15H20O2Si/c1-6-13-12(10-18(3,4)5)11-8-7-9-14(16-2)15(11)17-13/h6-9H,1,10H2,2-5H3
InChIKeyWGWHXVLLNXLNGT-UHFFFAOYSA-N
XLogP4.50
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane?
The IUPAC name of (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane (CID 177454044) is (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane.
What is the SMILES notation for (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane?
The canonical SMILES for (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane is C=Cc1oc2c(OC)cccc2c1C[Si](C)(C)C.
What is the InChIKey of (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane?
The InChIKey is WGWHXVLLNXLNGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2Si/c1-6-13-12(10-18(3,4)5)11-8-7-9-14(16-2)15(11)17-13/h6-9H,1,10H2,2-5H3.
What are the key properties of (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane?
(2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane has a molecular weight of 260.41 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenyl-7-methoxy-1-benzofuran-3-yl)methyl-trimethylsilane is sourced from PubChem (CID 177454044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).