trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane

C23H36O3Si3 — CID 91745415

IUPACtrimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane
SMILESC[Si](C)(C)Oc1ccc(/C=C/c2cc(O[Si](C)(C)C)cc(O[Si](C)(C)C)c2)cc1
InChIInChI=1S/C23H36O3Si3/c1-27(2,3)24-21-14-12-19(13-15-21)10-11-20-16-22(25-28(4,5)6)18-23(17-20)26-29(7,8)9/h10-18H,1-9H3/b11-10+
InChIKeyOYEDQJUIBMBCRH-ZHACJKMWSA-N
MW444.80 g/mol
LogP7.50
Rot. Bonds8

About trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane

trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane (PubChem CID 91745415) has the molecular formula C23H36O3Si3 and a molecular weight of 444.80 g/mol. Its IUPAC name is trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane.

Molecular Properties

Compound Nametrimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane
PubChem CID91745415
Molecular FormulaC23H36O3Si3
Molecular Weight444.80 g/mol
Exact Mass444.20
IUPAC Nametrimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane
SMILESC[Si](C)(C)Oc1ccc(/C=C/c2cc(O[Si](C)(C)C)cc(O[Si](C)(C)C)c2)cc1
InChIInChI=1S/C23H36O3Si3/c1-27(2,3)24-21-14-12-19(13-15-21)10-11-20-16-22(25-28(4,5)6)18-23(17-20)26-29(7,8)9/h10-18H,1-9H3/b11-10+
InChIKeyOYEDQJUIBMBCRH-ZHACJKMWSA-N
XLogP7.50
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.80
LogP ≤ 57.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane?
The IUPAC name of trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane (CID 91745415) is trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane.
What is the SMILES notation for trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane?
The canonical SMILES for trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane is C[Si](C)(C)Oc1ccc(/C=C/c2cc(O[Si](C)(C)C)cc(O[Si](C)(C)C)c2)cc1.
What is the InChIKey of trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane?
The InChIKey is OYEDQJUIBMBCRH-ZHACJKMWSA-N. The full InChI is InChI=1S/C23H36O3Si3/c1-27(2,3)24-21-14-12-19(13-15-21)10-11-20-16-22(25-28(4,5)6)18-23(17-20)26-29(7,8)9/h10-18H,1-9H3/b11-10+.
What are the key properties of trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane?
trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane has a molecular weight of 444.80 g/mol, XLogP of 7.50, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-trimethylsilyloxy-5-[(E)-2-(4-trimethylsilyloxyphenyl)ethenyl]phenoxy]silane is sourced from PubChem (CID 91745415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).