CID 23591786

C7H21O12Si8 — CID 23591786

IUPAC—
SMILESC[Si]12O[Si]3O[Si]4(C)O[Si](C)(O1)O[Si]1(C)O[Si](C)(O2)O[Si](C)(O3)O[Si](C)(O4)O1
InChIInChI=1S/C7H21O12Si8/c1-21-8-20-9-22(2)13-24(4,11-21)17-27(7)18-25(5,12-21)14-23(3,10-20)16-26(6,15-22)19-27/h1-7H3
InChIKeyDFULCWJGLSCGEE-UHFFFAOYSA-N
MW521.92 g/mol
LogP0.22
Rot. Bonds

About CID 23591786

CID 23591786 (PubChem CID 23591786) has the molecular formula C7H21O12Si8 and a molecular weight of 521.92 g/mol.

Molecular Properties

Compound NameCID 23591786
PubChem CID23591786
Molecular FormulaC7H21O12Si8
Molecular Weight521.92 g/mol
Exact Mass520.92
IUPAC Name—
SMILESC[Si]12O[Si]3O[Si]4(C)O[Si](C)(O1)O[Si]1(C)O[Si](C)(O2)O[Si](C)(O3)O[Si](C)(O4)O1
InChIInChI=1S/C7H21O12Si8/c1-21-8-20-9-22(2)13-24(4,11-21)17-27(7)18-25(5,12-21)14-23(3,10-20)16-26(6,15-22)19-27/h1-7H3
InChIKeyDFULCWJGLSCGEE-UHFFFAOYSA-N
XLogP0.22
TPSA110.76 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500521.92
LogP ≤ 50.22
H-Bond Donors ≤ 50
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 23591786?
The IUPAC name of CID 23591786 (CID 23591786) is not available.
What is the SMILES notation for CID 23591786?
The canonical SMILES for CID 23591786 is C[Si]12O[Si]3O[Si]4(C)O[Si](C)(O1)O[Si]1(C)O[Si](C)(O2)O[Si](C)(O3)O[Si](C)(O4)O1.
What is the InChIKey of CID 23591786?
The InChIKey is DFULCWJGLSCGEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H21O12Si8/c1-21-8-20-9-22(2)13-24(4,11-21)17-27(7)18-25(5,12-21)14-23(3,10-20)16-26(6,15-22)19-27/h1-7H3.
What are the key properties of CID 23591786?
CID 23591786 has a molecular weight of 521.92 g/mol, XLogP of 0.22, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23591786 is sourced from PubChem (CID 23591786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).