CID 58683093

C6H10O4Si+2 — CID 58683093

IUPAC—
SMILES[CH+]1CCO[Si]2(O1)O[CH+]CCO2
InChIInChI=1S/C6H10O4Si/c1-3-7-11(8-4-1)9-5-2-6-10-11/h3,5H,1-2,4,6H2/q+2
InChIKeySMGYRCKQHQAUOC-UHFFFAOYSA-N
MW174.23 g/mol
LogP0.62
Rot. Bonds

About CID 58683093

CID 58683093 (PubChem CID 58683093) has the molecular formula C6H10O4Si+2 and a molecular weight of 174.23 g/mol.

Molecular Properties

Compound NameCID 58683093
PubChem CID58683093
Molecular FormulaC6H10O4Si+2
Molecular Weight174.23 g/mol
Exact Mass174.03
IUPAC Name—
SMILES[CH+]1CCO[Si]2(O1)O[CH+]CCO2
InChIInChI=1S/C6H10O4Si/c1-3-7-11(8-4-1)9-5-2-6-10-11/h3,5H,1-2,4,6H2/q+2
InChIKeySMGYRCKQHQAUOC-UHFFFAOYSA-N
XLogP0.62
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.23
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 58683093?
The IUPAC name of CID 58683093 (CID 58683093) is not available.
What is the SMILES notation for CID 58683093?
The canonical SMILES for CID 58683093 is [CH+]1CCO[Si]2(O1)O[CH+]CCO2.
What is the InChIKey of CID 58683093?
The InChIKey is SMGYRCKQHQAUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O4Si/c1-3-7-11(8-4-1)9-5-2-6-10-11/h3,5H,1-2,4,6H2/q+2.
What are the key properties of CID 58683093?
CID 58683093 has a molecular weight of 174.23 g/mol, XLogP of 0.62, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58683093 is sourced from PubChem (CID 58683093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).