CID 20592112

C6H21O7Si8 — CID 20592112

IUPAC—
SMILESCO[Si]([Si])([Si]O)[Si](O[Si]O)(O[Si](C)(C)[Si](C)=O)[Si](C)(C)O
InChIInChI=1S/C6H21O7Si8/c1-11-21(14,16-8)20(12-15-7,18(3,4)10)13-19(5,6)17(2)9/h7-8,10H,1-6H3
InChIKeyTXSDWPWWMBLRNX-UHFFFAOYSA-N
MW429.92 g/mol
LogP-1.96
Rot. Bonds9

About CID 20592112

CID 20592112 (PubChem CID 20592112) has the molecular formula C6H21O7Si8 and a molecular weight of 429.92 g/mol.

Molecular Properties

Compound NameCID 20592112
PubChem CID20592112
Molecular FormulaC6H21O7Si8
Molecular Weight429.92 g/mol
Exact Mass428.94
IUPAC Name—
SMILESCO[Si]([Si])([Si]O)[Si](O[Si]O)(O[Si](C)(C)[Si](C)=O)[Si](C)(C)O
InChIInChI=1S/C6H21O7Si8/c1-11-21(14,16-8)20(12-15-7,18(3,4)10)13-19(5,6)17(2)9/h7-8,10H,1-6H3
InChIKeyTXSDWPWWMBLRNX-UHFFFAOYSA-N
XLogP-1.96
TPSA105.45 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.92
LogP ≤ 5-1.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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 20592112?
The IUPAC name of CID 20592112 (CID 20592112) is not available.
What is the SMILES notation for CID 20592112?
The canonical SMILES for CID 20592112 is CO[Si]([Si])([Si]O)[Si](O[Si]O)(O[Si](C)(C)[Si](C)=O)[Si](C)(C)O.
What is the InChIKey of CID 20592112?
The InChIKey is TXSDWPWWMBLRNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H21O7Si8/c1-11-21(14,16-8)20(12-15-7,18(3,4)10)13-19(5,6)17(2)9/h7-8,10H,1-6H3.
What are the key properties of CID 20592112?
CID 20592112 has a molecular weight of 429.92 g/mol, XLogP of -1.96, 9 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for CID 20592112 is sourced from PubChem (CID 20592112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).