[(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane

C18H28OSi — CID 54324109

IUPAC[(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane
SMILESC=C[Si](C)(C)O/C=C(\C)Cc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H28OSi/c1-8-20(6,7)19-14-15(2)13-16-9-11-17(12-10-16)18(3,4)5/h8-12,14H,1,13H2,2-7H3/b15-14+
InChIKeyDTBBZCSYVDQRMX-CCEZHUSRSA-N
MW288.51 g/mol
LogP5.38
Rot. Bonds5

About [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane

[(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane (PubChem CID 54324109) has the molecular formula C18H28OSi and a molecular weight of 288.51 g/mol. Its IUPAC name is [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane.

Molecular Properties

Compound Name[(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane
PubChem CID54324109
Molecular FormulaC18H28OSi
Molecular Weight288.51 g/mol
Exact Mass288.19
IUPAC Name[(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane
SMILESC=C[Si](C)(C)O/C=C(\C)Cc1ccc(C(C)(C)C)cc1
InChIInChI=1S/C18H28OSi/c1-8-20(6,7)19-14-15(2)13-16-9-11-17(12-10-16)18(3,4)5/h8-12,14H,1,13H2,2-7H3/b15-14+
InChIKeyDTBBZCSYVDQRMX-CCEZHUSRSA-N
XLogP5.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.51
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane?
The IUPAC name of [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane (CID 54324109) is [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane.
What is the SMILES notation for [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane?
The canonical SMILES for [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane is C=C[Si](C)(C)O/C=C(\C)Cc1ccc(C(C)(C)C)cc1.
What is the InChIKey of [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane?
The InChIKey is DTBBZCSYVDQRMX-CCEZHUSRSA-N. The full InChI is InChI=1S/C18H28OSi/c1-8-20(6,7)19-14-15(2)13-16-9-11-17(12-10-16)18(3,4)5/h8-12,14H,1,13H2,2-7H3/b15-14+.
What are the key properties of [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane?
[(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane has a molecular weight of 288.51 g/mol, XLogP of 5.38, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-(4-tert-butylphenyl)-2-methylprop-1-enoxy]-ethenyl-dimethylsilane is sourced from PubChem (CID 54324109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).