dibutylphosphanyl trifluoromethanesulfonate;silver

C9H18AgF3O3PS — CID 174435090

IUPACdibutylphosphanyl trifluoromethanesulfonate;silver
SMILESCCCCP(CCCC)OS(=O)(=O)C(F)(F)F.[Ag]
InChIInChI=1S/C9H18F3O3PS.Ag/c1-3-5-7-16(8-6-4-2)15-17(13,14)9(10,11)12;/h3-8H2,1-2H3;
InChIKeyMAYRNGJXHMZSDE-UHFFFAOYSA-N
MW402.14 g/mol
LogP3.85
Rot. Bonds8

About dibutylphosphanyl trifluoromethanesulfonate;silver

dibutylphosphanyl trifluoromethanesulfonate;silver (PubChem CID 174435090) has the molecular formula C9H18AgF3O3PS and a molecular weight of 402.14 g/mol. Its IUPAC name is dibutylphosphanyl trifluoromethanesulfonate;silver.

Molecular Properties

Compound Namedibutylphosphanyl trifluoromethanesulfonate;silver
PubChem CID174435090
Molecular FormulaC9H18AgF3O3PS
Molecular Weight402.14 g/mol
Exact Mass400.97
IUPAC Namedibutylphosphanyl trifluoromethanesulfonate;silver
SMILESCCCCP(CCCC)OS(=O)(=O)C(F)(F)F.[Ag]
InChIInChI=1S/C9H18F3O3PS.Ag/c1-3-5-7-16(8-6-4-2)15-17(13,14)9(10,11)12;/h3-8H2,1-2H3;
InChIKeyMAYRNGJXHMZSDE-UHFFFAOYSA-N
XLogP3.85
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.14
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tricosane;trifluoromethanesulfonic acid
CID 161255361
tributyl(trifluoromethylsulfonyloxy)phosphanium
CID 87465902
methyl trifluoromethanesulfonate;silver
CID 174859792
[tributyl(octyl)-λ5-phosphanyl] trifluoromethanesulfonate
CID 87573486
1-fluorononyl trifluoromethanesulfonate
CID 122369701
pentanoic acid;trifluoromethylsulfonyl trifluoromethanesulfonate
CID 159747202
amino(trioctyl)phosphanium;methyl trifluoromethanesulfonate
CID 174815242
[tributyl(methyl)-λ5-phosphanyl] trifluoromethanesulfonate
CID 87223937
butyl-methoxy-propylphosphane
CID 150191747
nonane;1,1,1-trifluoro-N-(trifluoromethylsulfonyl)methanesulfonamide
CID 175845377
[2-decoxy-3-(trifluoromethylsulfonyloxy)propyl] trifluoromethanesulfonate
CID 19891154
hexyl 2-(trifluoromethylsulfonyloxy)acetate
CID 131725253

Frequently Asked Questions

What is the IUPAC name of dibutylphosphanyl trifluoromethanesulfonate;silver?
The IUPAC name of dibutylphosphanyl trifluoromethanesulfonate;silver (CID 174435090) is dibutylphosphanyl trifluoromethanesulfonate;silver.
What is the SMILES notation for dibutylphosphanyl trifluoromethanesulfonate;silver?
The canonical SMILES for dibutylphosphanyl trifluoromethanesulfonate;silver is CCCCP(CCCC)OS(=O)(=O)C(F)(F)F.[Ag].
What is the InChIKey of dibutylphosphanyl trifluoromethanesulfonate;silver?
The InChIKey is MAYRNGJXHMZSDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F3O3PS.Ag/c1-3-5-7-16(8-6-4-2)15-17(13,14)9(10,11)12;/h3-8H2,1-2H3;.
What are the key properties of dibutylphosphanyl trifluoromethanesulfonate;silver?
dibutylphosphanyl trifluoromethanesulfonate;silver has a molecular weight of 402.14 g/mol, XLogP of 3.85, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibutylphosphanyl trifluoromethanesulfonate;silver is sourced from PubChem (CID 174435090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).