4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol

C15H24O4Si — CID 20667337

IUPAC4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol
SMILESC=CCO[Si](C)(C)CCCOc1ccc(O)c(OC)c1
InChIInChI=1S/C15H24O4Si/c1-5-9-19-20(3,4)11-6-10-18-13-7-8-14(16)15(12-13)17-2/h5,7-8,12,16H,1,6,9-11H2,2-4H3
InChIKeyRZJUKOLWWYUOFB-UHFFFAOYSA-N
MW296.44 g/mol
LogP3.58
Rot. Bonds9

About 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol

4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol (PubChem CID 20667337) has the molecular formula C15H24O4Si and a molecular weight of 296.44 g/mol. Its IUPAC name is 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol.

Molecular Properties

Compound Name4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol
PubChem CID20667337
Molecular FormulaC15H24O4Si
Molecular Weight296.44 g/mol
Exact Mass296.14
IUPAC Name4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol
SMILESC=CCO[Si](C)(C)CCCOc1ccc(O)c(OC)c1
InChIInChI=1S/C15H24O4Si/c1-5-9-19-20(3,4)11-6-10-18-13-7-8-14(16)15(12-13)17-2/h5,7-8,12,16H,1,6,9-11H2,2-4H3
InChIKeyRZJUKOLWWYUOFB-UHFFFAOYSA-N
XLogP3.58
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol?
The IUPAC name of 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol (CID 20667337) is 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol.
What is the SMILES notation for 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol?
The canonical SMILES for 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol is C=CCO[Si](C)(C)CCCOc1ccc(O)c(OC)c1.
What is the InChIKey of 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol?
The InChIKey is RZJUKOLWWYUOFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O4Si/c1-5-9-19-20(3,4)11-6-10-18-13-7-8-14(16)15(12-13)17-2/h5,7-8,12,16H,1,6,9-11H2,2-4H3.
What are the key properties of 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol?
4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol has a molecular weight of 296.44 g/mol, XLogP of 3.58, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[dimethyl(prop-2-enoxy)silyl]propoxy]-2-methoxyphenol is sourced from PubChem (CID 20667337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).