[(E)-but-2-enoxy]-tert-butyl-diphenylsilane

C20H26OSi — CID 71739219

IUPAC[(E)-but-2-enoxy]-tert-butyl-diphenylsilane
SMILESC/C=C/CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H26OSi/c1-5-6-17-21-22(20(2,3)4,18-13-9-7-10-14-18)19-15-11-8-12-16-19/h5-16H,17H2,1-4H3/b6-5+
InChIKeyQAMLOULRVKRYAH-AATRIKPKSA-N
MW310.51 g/mol
LogP4.14
Rot. Bonds5

About [(E)-but-2-enoxy]-tert-butyl-diphenylsilane

[(E)-but-2-enoxy]-tert-butyl-diphenylsilane (PubChem CID 71739219) has the molecular formula C20H26OSi and a molecular weight of 310.51 g/mol. Its IUPAC name is [(E)-but-2-enoxy]-tert-butyl-diphenylsilane.

Molecular Properties

Compound Name[(E)-but-2-enoxy]-tert-butyl-diphenylsilane
PubChem CID71739219
Molecular FormulaC20H26OSi
Molecular Weight310.51 g/mol
Exact Mass310.18
IUPAC Name[(E)-but-2-enoxy]-tert-butyl-diphenylsilane
SMILESC/C=C/CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C20H26OSi/c1-5-6-17-21-22(20(2,3)4,18-13-9-7-10-14-18)19-15-11-8-12-16-19/h5-16H,17H2,1-4H3/b6-5+
InChIKeyQAMLOULRVKRYAH-AATRIKPKSA-N
XLogP4.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.51
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 [(E)-but-2-enoxy]-tert-butyl-diphenylsilane?
The IUPAC name of [(E)-but-2-enoxy]-tert-butyl-diphenylsilane (CID 71739219) is [(E)-but-2-enoxy]-tert-butyl-diphenylsilane.
What is the SMILES notation for [(E)-but-2-enoxy]-tert-butyl-diphenylsilane?
The canonical SMILES for [(E)-but-2-enoxy]-tert-butyl-diphenylsilane is C/C=C/CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of [(E)-but-2-enoxy]-tert-butyl-diphenylsilane?
The InChIKey is QAMLOULRVKRYAH-AATRIKPKSA-N. The full InChI is InChI=1S/C20H26OSi/c1-5-6-17-21-22(20(2,3)4,18-13-9-7-10-14-18)19-15-11-8-12-16-19/h5-16H,17H2,1-4H3/b6-5+.
What are the key properties of [(E)-but-2-enoxy]-tert-butyl-diphenylsilane?
[(E)-but-2-enoxy]-tert-butyl-diphenylsilane has a molecular weight of 310.51 g/mol, XLogP of 4.14, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-but-2-enoxy]-tert-butyl-diphenylsilane is sourced from PubChem (CID 71739219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).