CID 14905181

C8H16F3O3SSi — CID 14905181

IUPAC—
SMILESCC(C)[Si](OS(=O)(=O)C(F)(F)F)C(C)(C)C
InChIInChI=1S/C8H16F3O3SSi/c1-6(2)16(7(3,4)5)14-15(12,13)8(9,10)11/h6H,1-5H3
InChIKeyOHIHMBCMGATRNU-UHFFFAOYSA-N
MW277.36 g/mol
LogP3.05
Rot. Bonds3

About CID 14905181

CID 14905181 (PubChem CID 14905181) has the molecular formula C8H16F3O3SSi and a molecular weight of 277.36 g/mol.

Molecular Properties

Compound NameCID 14905181
PubChem CID14905181
Molecular FormulaC8H16F3O3SSi
Molecular Weight277.36 g/mol
Exact Mass277.05
IUPAC Name—
SMILESCC(C)[Si](OS(=O)(=O)C(F)(F)F)C(C)(C)C
InChIInChI=1S/C8H16F3O3SSi/c1-6(2)16(7(3,4)5)14-15(12,13)8(9,10)11/h6H,1-5H3
InChIKeyOHIHMBCMGATRNU-UHFFFAOYSA-N
XLogP3.05
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 14905181?
The IUPAC name of CID 14905181 (CID 14905181) is not available.
What is the SMILES notation for CID 14905181?
The canonical SMILES for CID 14905181 is CC(C)[Si](OS(=O)(=O)C(F)(F)F)C(C)(C)C.
What is the InChIKey of CID 14905181?
The InChIKey is OHIHMBCMGATRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F3O3SSi/c1-6(2)16(7(3,4)5)14-15(12,13)8(9,10)11/h6H,1-5H3.
What are the key properties of CID 14905181?
CID 14905181 has a molecular weight of 277.36 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 14905181 is sourced from PubChem (CID 14905181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).