1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane

C24H24O5Si4 — CID 175552792

IUPAC1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane
SMILESO[Si]1(O)[Si](O)(Oc2ccccc2)[Si](c2ccccc2)(c2ccccc2)[Si]1(O)c1ccccc1
InChIInChI=1S/C24H24O5Si4/c25-31(24-19-11-4-12-20-24)30(22-15-7-2-8-16-22,23-17-9-3-10-18-23)33(28,32(31,26)27)29-21-13-5-1-6-14-21/h1-20,25-28H
InChIKeyDZDWUORPDJSVIB-UHFFFAOYSA-N
MW504.80 g/mol
LogP0.36
Rot. Bonds5

About 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane

1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane (PubChem CID 175552792) has the molecular formula C24H24O5Si4 and a molecular weight of 504.80 g/mol. Its IUPAC name is 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane.

Molecular Properties

Compound Name1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane
PubChem CID175552792
Molecular FormulaC24H24O5Si4
Molecular Weight504.80 g/mol
Exact Mass504.07
IUPAC Name1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane
SMILESO[Si]1(O)[Si](O)(Oc2ccccc2)[Si](c2ccccc2)(c2ccccc2)[Si]1(O)c1ccccc1
InChIInChI=1S/C24H24O5Si4/c25-31(24-19-11-4-12-20-24)30(22-15-7-2-8-16-22,23-17-9-3-10-18-23)33(28,32(31,26)27)29-21-13-5-1-6-14-21/h1-20,25-28H
InChIKeyDZDWUORPDJSVIB-UHFFFAOYSA-N
XLogP0.36
TPSA90.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500504.80
LogP ≤ 50.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane?
The IUPAC name of 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane (CID 175552792) is 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane.
What is the SMILES notation for 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane?
The canonical SMILES for 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane is O[Si]1(O)[Si](O)(Oc2ccccc2)[Si](c2ccccc2)(c2ccccc2)[Si]1(O)c1ccccc1.
What is the InChIKey of 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane?
The InChIKey is DZDWUORPDJSVIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O5Si4/c25-31(24-19-11-4-12-20-24)30(22-15-7-2-8-16-22,23-17-9-3-10-18-23)33(28,32(31,26)27)29-21-13-5-1-6-14-21/h1-20,25-28H.
What are the key properties of 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane?
1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane has a molecular weight of 504.80 g/mol, XLogP of 0.36, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,4-tetrahydroxy-2-phenoxy-3,3,4-triphenyltetrasiletane is sourced from PubChem (CID 175552792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).