but-2-enoxy(triphenyl)silane

C22H22OSi — CID 4292154

IUPACbut-2-enoxy(triphenyl)silane
SMILESCC=CCO[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22OSi/c1-2-3-19-23-24(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h2-18H,19H2,1H3
InChIKeyCZOWRNDKWXEGMM-UHFFFAOYSA-N
MW330.50 g/mol
LogP3.25
Rot. Bonds6

About but-2-enoxy(triphenyl)silane

but-2-enoxy(triphenyl)silane (PubChem CID 4292154) has the molecular formula C22H22OSi and a molecular weight of 330.50 g/mol. Its IUPAC name is but-2-enoxy(triphenyl)silane.

Molecular Properties

Compound Namebut-2-enoxy(triphenyl)silane
PubChem CID4292154
Molecular FormulaC22H22OSi
Molecular Weight330.50 g/mol
Exact Mass330.14
IUPAC Namebut-2-enoxy(triphenyl)silane
SMILESCC=CCO[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H22OSi/c1-2-3-19-23-24(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h2-18H,19H2,1H3
InChIKeyCZOWRNDKWXEGMM-UHFFFAOYSA-N
XLogP3.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.50
LogP ≤ 53.25
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'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of but-2-enoxy(triphenyl)silane?
The IUPAC name of but-2-enoxy(triphenyl)silane (CID 4292154) is but-2-enoxy(triphenyl)silane.
What is the SMILES notation for but-2-enoxy(triphenyl)silane?
The canonical SMILES for but-2-enoxy(triphenyl)silane is CC=CCO[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of but-2-enoxy(triphenyl)silane?
The InChIKey is CZOWRNDKWXEGMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22OSi/c1-2-3-19-23-24(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h2-18H,19H2,1H3.
What are the key properties of but-2-enoxy(triphenyl)silane?
but-2-enoxy(triphenyl)silane has a molecular weight of 330.50 g/mol, XLogP of 3.25, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-enoxy(triphenyl)silane is sourced from PubChem (CID 4292154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).