CID 18698904

C4H9FO3SSi — CID 18698904

IUPAC—
SMILESCC(C)[Si]COS(=O)(=O)F
InChIInChI=1S/C4H9FO3SSi/c1-4(2)10-3-8-9(5,6)7/h4H,3H2,1-2H3
InChIKeySGZDSCBSXCBTKG-UHFFFAOYSA-N
MW184.26 g/mol
LogP0.71
Rot. Bonds4

About CID 18698904

CID 18698904 (PubChem CID 18698904) has the molecular formula C4H9FO3SSi and a molecular weight of 184.26 g/mol.

Molecular Properties

Compound NameCID 18698904
PubChem CID18698904
Molecular FormulaC4H9FO3SSi
Molecular Weight184.26 g/mol
Exact Mass184.00
IUPAC Name—
SMILESCC(C)[Si]COS(=O)(=O)F
InChIInChI=1S/C4H9FO3SSi/c1-4(2)10-3-8-9(5,6)7/h4H,3H2,1-2H3
InChIKeySGZDSCBSXCBTKG-UHFFFAOYSA-N
XLogP0.71
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 18698904?
The IUPAC name of CID 18698904 (CID 18698904) is not available.
What is the SMILES notation for CID 18698904?
The canonical SMILES for CID 18698904 is CC(C)[Si]COS(=O)(=O)F.
What is the InChIKey of CID 18698904?
The InChIKey is SGZDSCBSXCBTKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9FO3SSi/c1-4(2)10-3-8-9(5,6)7/h4H,3H2,1-2H3.
What are the key properties of CID 18698904?
CID 18698904 has a molecular weight of 184.26 g/mol, XLogP of 0.71, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18698904 is sourced from PubChem (CID 18698904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).