2-prop-2-enyl-4-trimethoxysilylphenol

C12H18O4Si — CID 139623862

IUPAC2-prop-2-enyl-4-trimethoxysilylphenol
SMILESC=CCc1cc([Si](OC)(OC)OC)ccc1O
InChIInChI=1S/C12H18O4Si/c1-5-6-10-9-11(7-8-12(10)13)17(14-2,15-3)16-4/h5,7-9,13H,1,6H2,2-4H3
InChIKeyMYWPQMKLPKQPQV-UHFFFAOYSA-N
MW254.36 g/mol
LogP1.21
Rot. Bonds6

About 2-prop-2-enyl-4-trimethoxysilylphenol

2-prop-2-enyl-4-trimethoxysilylphenol (PubChem CID 139623862) has the molecular formula C12H18O4Si and a molecular weight of 254.36 g/mol. Its IUPAC name is 2-prop-2-enyl-4-trimethoxysilylphenol.

Molecular Properties

Compound Name2-prop-2-enyl-4-trimethoxysilylphenol
PubChem CID139623862
Molecular FormulaC12H18O4Si
Molecular Weight254.36 g/mol
Exact Mass254.10
IUPAC Name2-prop-2-enyl-4-trimethoxysilylphenol
SMILESC=CCc1cc([Si](OC)(OC)OC)ccc1O
InChIInChI=1S/C12H18O4Si/c1-5-6-10-9-11(7-8-12(10)13)17(14-2,15-3)16-4/h5,7-9,13H,1,6H2,2-4H3
InChIKeyMYWPQMKLPKQPQV-UHFFFAOYSA-N
XLogP1.21
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

trimethoxy-(4-prop-2-enylphenyl)silane
CID 66685892
4-(4-methoxyphenyl)-2-prop-2-enylphenol
CID 54757995
4-(4-hydroxyphenyl)-2-prop-2-enylphenol
CID 70597664
4-prop-2-enoxy-2-prop-2-enylphenol
CID 45091477
2-methoxy-3-methyl-4-prop-2-enylphenol
CID 15607491
4-methoxy-6-prop-2-enylbenzene-1,3-diol
CID 15775117
4-[(1R)-1-aminoethyl]-2-prop-2-enylphenol
CID 130657351
4-(1-aminoethyl)-2-prop-2-enylphenol
CID 54848971
4-hydroxy-3-prop-2-enylbenzoic acid;zinc
CID 67875987
5-methoxy-2-prop-2-enylphenol
CID 6424515
2,4,5-tris(prop-2-enyl)phenol
CID 20562879
4-(2-methoxy-5-prop-2-enylphenyl)-2-prop-2-enylphenol
CID 11857938

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enyl-4-trimethoxysilylphenol?
The IUPAC name of 2-prop-2-enyl-4-trimethoxysilylphenol (CID 139623862) is 2-prop-2-enyl-4-trimethoxysilylphenol.
What is the SMILES notation for 2-prop-2-enyl-4-trimethoxysilylphenol?
The canonical SMILES for 2-prop-2-enyl-4-trimethoxysilylphenol is C=CCc1cc([Si](OC)(OC)OC)ccc1O.
What is the InChIKey of 2-prop-2-enyl-4-trimethoxysilylphenol?
The InChIKey is MYWPQMKLPKQPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O4Si/c1-5-6-10-9-11(7-8-12(10)13)17(14-2,15-3)16-4/h5,7-9,13H,1,6H2,2-4H3.
What are the key properties of 2-prop-2-enyl-4-trimethoxysilylphenol?
2-prop-2-enyl-4-trimethoxysilylphenol has a molecular weight of 254.36 g/mol, XLogP of 1.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enyl-4-trimethoxysilylphenol is sourced from PubChem (CID 139623862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).