silver 1,1,2,2,2-pentafluoroethanethiolate

C2AgF5S — CID 171060674

IUPACsilver 1,1,2,2,2-pentafluoroethanethiolate
SMILESFC(F)(F)C(F)(F)[S-].[Ag+]
InChIInChI=1S/C2HF5S.Ag/c3-1(4,5)2(6,7)8;/h8H;/q;+1/p-1
InChIKeyRQHQIXMPVJAMJE-UHFFFAOYSA-M
MW258.95 g/mol
LogP1.69
Rot. Bonds

About silver 1,1,2,2,2-pentafluoroethanethiolate

silver 1,1,2,2,2-pentafluoroethanethiolate (PubChem CID 171060674) has the molecular formula C2AgF5S and a molecular weight of 258.95 g/mol. Its IUPAC name is silver 1,1,2,2,2-pentafluoroethanethiolate.

Molecular Properties

Compound Namesilver 1,1,2,2,2-pentafluoroethanethiolate
PubChem CID171060674
Molecular FormulaC2AgF5S
Molecular Weight258.95 g/mol
Exact Mass257.87
IUPAC Namesilver 1,1,2,2,2-pentafluoroethanethiolate
SMILESFC(F)(F)C(F)(F)[S-].[Ag+]
InChIInChI=1S/C2HF5S.Ag/c3-1(4,5)2(6,7)8;/h8H;/q;+1/p-1
InChIKeyRQHQIXMPVJAMJE-UHFFFAOYSA-M
XLogP1.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.95
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of silver 1,1,2,2,2-pentafluoroethanethiolate?
The IUPAC name of silver 1,1,2,2,2-pentafluoroethanethiolate (CID 171060674) is silver 1,1,2,2,2-pentafluoroethanethiolate.
What is the SMILES notation for silver 1,1,2,2,2-pentafluoroethanethiolate?
The canonical SMILES for silver 1,1,2,2,2-pentafluoroethanethiolate is FC(F)(F)C(F)(F)[S-].[Ag+].
What is the InChIKey of silver 1,1,2,2,2-pentafluoroethanethiolate?
The InChIKey is RQHQIXMPVJAMJE-UHFFFAOYSA-M. The full InChI is InChI=1S/C2HF5S.Ag/c3-1(4,5)2(6,7)8;/h8H;/q;+1/p-1.
What are the key properties of silver 1,1,2,2,2-pentafluoroethanethiolate?
silver 1,1,2,2,2-pentafluoroethanethiolate has a molecular weight of 258.95 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for silver 1,1,2,2,2-pentafluoroethanethiolate is sourced from PubChem (CID 171060674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).