fluoromethanesulfonic acid;methanesulfonic acid

C2H7FO6S2 — CID 87286738

IUPACfluoromethanesulfonic acid;methanesulfonic acid
SMILESCS(=O)(=O)O.O=S(=O)(O)CF
InChIInChI=1S/CH3FO3S.CH4O3S/c2-1-6(3,4)5;1-5(2,3)4/h1H2,(H,3,4,5);1H3,(H,2,3,4)
InChIKeyYKGORAXSKYVQEX-UHFFFAOYSA-N
MW210.20 g/mol
LogP-0.69
Rot. Bonds1

About fluoromethanesulfonic acid;methanesulfonic acid

fluoromethanesulfonic acid;methanesulfonic acid (PubChem CID 87286738) has the molecular formula C2H7FO6S2 and a molecular weight of 210.20 g/mol. Its IUPAC name is fluoromethanesulfonic acid;methanesulfonic acid.

Molecular Properties

Compound Namefluoromethanesulfonic acid;methanesulfonic acid
PubChem CID87286738
Molecular FormulaC2H7FO6S2
Molecular Weight210.20 g/mol
Exact Mass209.97
IUPAC Namefluoromethanesulfonic acid;methanesulfonic acid
SMILESCS(=O)(=O)O.O=S(=O)(O)CF
InChIInChI=1S/CH3FO3S.CH4O3S/c2-1-6(3,4)5;1-5(2,3)4/h1H2,(H,3,4,5);1H3,(H,2,3,4)
InChIKeyYKGORAXSKYVQEX-UHFFFAOYSA-N
XLogP-0.69
TPSA108.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.20
LogP ≤ 5-0.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

ethane-1,1-diol;fluoromethanesulfonic acid
CID 87128075
1,2-difluoroethanol;methanesulfonic acid
CID 175310742
CID 87129852
CID 87129852
hydron;methanesulfonic acid
CID 19767432
methanesulfonic acid;hydrate
CID 87278985
methanesulfonic acid;stibane
CID 173129060
ethane;methanesulfonic acid
CID 87194848
CID 72786756
CID 72786756
methane;methanesulfonic acid
CID 87535456
dichloromethane;methanesulfonic acid
CID 22465915
alumane;methanesulfonic acid;hydrofluoride
CID 174812209
sodium;methanesulfonic acid;iodide
CID 87541742

Frequently Asked Questions

What is the IUPAC name of fluoromethanesulfonic acid;methanesulfonic acid?
The IUPAC name of fluoromethanesulfonic acid;methanesulfonic acid (CID 87286738) is fluoromethanesulfonic acid;methanesulfonic acid.
What is the SMILES notation for fluoromethanesulfonic acid;methanesulfonic acid?
The canonical SMILES for fluoromethanesulfonic acid;methanesulfonic acid is CS(=O)(=O)O.O=S(=O)(O)CF.
What is the InChIKey of fluoromethanesulfonic acid;methanesulfonic acid?
The InChIKey is YKGORAXSKYVQEX-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3FO3S.CH4O3S/c2-1-6(3,4)5;1-5(2,3)4/h1H2,(H,3,4,5);1H3,(H,2,3,4).
What are the key properties of fluoromethanesulfonic acid;methanesulfonic acid?
fluoromethanesulfonic acid;methanesulfonic acid has a molecular weight of 210.20 g/mol, XLogP of -0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethanesulfonic acid;methanesulfonic acid is sourced from PubChem (CID 87286738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).