[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane

C22H21ISi — CID 101465859

IUPAC[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane
SMILESC[Si](C)(/C=C(/c1ccccc1)c1ccc(I)cc1)c1ccccc1
InChIInChI=1S/C22H21ISi/c1-24(2,21-11-7-4-8-12-21)17-22(18-9-5-3-6-10-18)19-13-15-20(23)16-14-19/h3-17H,1-2H3/b22-17-
InChIKeyPWKCSJSAVVWYNM-XLNRJJMWSA-N
MW440.40 g/mol
LogP5.88
Rot. Bonds4

About [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane

[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane (PubChem CID 101465859) has the molecular formula C22H21ISi and a molecular weight of 440.40 g/mol. Its IUPAC name is [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane.

Molecular Properties

Compound Name[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane
PubChem CID101465859
Molecular FormulaC22H21ISi
Molecular Weight440.40 g/mol
Exact Mass440.05
IUPAC Name[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane
SMILESC[Si](C)(/C=C(/c1ccccc1)c1ccc(I)cc1)c1ccccc1
InChIInChI=1S/C22H21ISi/c1-24(2,21-11-7-4-8-12-21)17-22(18-9-5-3-6-10-18)19-13-15-20(23)16-14-19/h3-17H,1-2H3/b22-17-
InChIKeyPWKCSJSAVVWYNM-XLNRJJMWSA-N
XLogP5.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.40
LogP ≤ 55.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane?
The IUPAC name of [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane (CID 101465859) is [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane.
What is the SMILES notation for [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane?
The canonical SMILES for [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane is C[Si](C)(/C=C(/c1ccccc1)c1ccc(I)cc1)c1ccccc1.
What is the InChIKey of [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane?
The InChIKey is PWKCSJSAVVWYNM-XLNRJJMWSA-N. The full InChI is InChI=1S/C22H21ISi/c1-24(2,21-11-7-4-8-12-21)17-22(18-9-5-3-6-10-18)19-13-15-20(23)16-14-19/h3-17H,1-2H3/b22-17-.
What are the key properties of [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane?
[(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane has a molecular weight of 440.40 g/mol, XLogP of 5.88, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2-(4-iodophenyl)-2-phenylethenyl]-dimethyl-phenylsilane is sourced from PubChem (CID 101465859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).