CID 20824811

C8H25O12Si8 — CID 20824811

IUPAC—
SMILESC[Si]1O[Si]2(C)O[Si]3(C)O[Si](C)(O)O[Si]4(C)O[Si](C)(O1)O[Si](C)(O2)O[Si](C)(O3)O4
InChIInChI=1S/C8H25O12Si8/c1-21-10-23(3)14-25(5)12-22(2,9)13-26(6)15-24(4,11-21)17-27(7,16-23)20-28(8,18-25)19-26/h9H,1-8H3
InChIKeyZOQOUFJAUXETGQ-UHFFFAOYSA-N
MW537.96 g/mol
LogP0.31
Rot. Bonds

About CID 20824811

CID 20824811 (PubChem CID 20824811) has the molecular formula C8H25O12Si8 and a molecular weight of 537.96 g/mol.

Molecular Properties

Compound NameCID 20824811
PubChem CID20824811
Molecular FormulaC8H25O12Si8
Molecular Weight537.96 g/mol
Exact Mass536.95
IUPAC Name—
SMILESC[Si]1O[Si]2(C)O[Si]3(C)O[Si](C)(O)O[Si]4(C)O[Si](C)(O1)O[Si](C)(O2)O[Si](C)(O3)O4
InChIInChI=1S/C8H25O12Si8/c1-21-10-23(3)14-25(5)12-22(2,9)13-26(6)15-24(4,11-21)17-27(7,16-23)20-28(8,18-25)19-26/h9H,1-8H3
InChIKeyZOQOUFJAUXETGQ-UHFFFAOYSA-N
XLogP0.31
TPSA121.76 Ų
H-Bond Donors1
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500537.96
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1012

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 CID 20824811?
The IUPAC name of CID 20824811 (CID 20824811) is not available.
What is the SMILES notation for CID 20824811?
The canonical SMILES for CID 20824811 is C[Si]1O[Si]2(C)O[Si]3(C)O[Si](C)(O)O[Si]4(C)O[Si](C)(O1)O[Si](C)(O2)O[Si](C)(O3)O4.
What is the InChIKey of CID 20824811?
The InChIKey is ZOQOUFJAUXETGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H25O12Si8/c1-21-10-23(3)14-25(5)12-22(2,9)13-26(6)15-24(4,11-21)17-27(7,16-23)20-28(8,18-25)19-26/h9H,1-8H3.
What are the key properties of CID 20824811?
CID 20824811 has a molecular weight of 537.96 g/mol, XLogP of 0.31, 0 rotatable bonds, 1 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20824811 is sourced from PubChem (CID 20824811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).