[1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane

C13H24O2Si — CID 123880326

IUPAC[1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane
SMILESCc1cc(C(O[SiH](C)C)C(C)(C)C)c(C)o1
InChIInChI=1S/C13H24O2Si/c1-9-8-11(10(2)14-9)12(13(3,4)5)15-16(6)7/h8,12,16H,1-7H3
InChIKeyXHXNWCAKSFPQRH-UHFFFAOYSA-N
MW240.42 g/mol
LogP3.98
Rot. Bonds3

About [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane

[1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane (PubChem CID 123880326) has the molecular formula C13H24O2Si and a molecular weight of 240.42 g/mol. Its IUPAC name is [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane.

Molecular Properties

Compound Name[1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane
PubChem CID123880326
Molecular FormulaC13H24O2Si
Molecular Weight240.42 g/mol
Exact Mass240.15
IUPAC Name[1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane
SMILESCc1cc(C(O[SiH](C)C)C(C)(C)C)c(C)o1
InChIInChI=1S/C13H24O2Si/c1-9-8-11(10(2)14-9)12(13(3,4)5)15-16(6)7/h8,12,16H,1-7H3
InChIKeyXHXNWCAKSFPQRH-UHFFFAOYSA-N
XLogP3.98
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.42
LogP ≤ 53.98
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 [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane?
The IUPAC name of [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane (CID 123880326) is [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane.
What is the SMILES notation for [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane?
The canonical SMILES for [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane is Cc1cc(C(O[SiH](C)C)C(C)(C)C)c(C)o1.
What is the InChIKey of [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane?
The InChIKey is XHXNWCAKSFPQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2Si/c1-9-8-11(10(2)14-9)12(13(3,4)5)15-16(6)7/h8,12,16H,1-7H3.
What are the key properties of [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane?
[1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane has a molecular weight of 240.42 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethylfuran-3-yl)-2,2-dimethylpropoxy]-dimethylsilane is sourced from PubChem (CID 123880326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).