fluoromethanesulfinate;hydron

CH3FO2S — CID 174471713

IUPACfluoromethanesulfinate;hydron
SMILESO=S([O-])CF.[H+]
InChIInChI=1S/CH3FO2S/c2-1-5(3)4/h1H2,(H,3,4)
InChIKeyVSAVIUSEFTYPSF-UHFFFAOYSA-N
MW98.10 g/mol
LogP-0.09
Rot. Bonds1

About fluoromethanesulfinate;hydron

fluoromethanesulfinate;hydron (PubChem CID 174471713) has the molecular formula CH3FO2S and a molecular weight of 98.10 g/mol. Its IUPAC name is fluoromethanesulfinate;hydron.

Molecular Properties

Compound Namefluoromethanesulfinate;hydron
PubChem CID174471713
Molecular FormulaCH3FO2S
Molecular Weight98.10 g/mol
Exact Mass97.98
IUPAC Namefluoromethanesulfinate;hydron
SMILESO=S([O-])CF.[H+]
InChIInChI=1S/CH3FO2S/c2-1-5(3)4/h1H2,(H,3,4)
InChIKeyVSAVIUSEFTYPSF-UHFFFAOYSA-N
XLogP-0.09
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.10
LogP ≤ 5-0.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluoromethanesulfinate;hydron?
The IUPAC name of fluoromethanesulfinate;hydron (CID 174471713) is fluoromethanesulfinate;hydron.
What is the SMILES notation for fluoromethanesulfinate;hydron?
The canonical SMILES for fluoromethanesulfinate;hydron is O=S([O-])CF.[H+].
What is the InChIKey of fluoromethanesulfinate;hydron?
The InChIKey is VSAVIUSEFTYPSF-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3FO2S/c2-1-5(3)4/h1H2,(H,3,4).
What are the key properties of fluoromethanesulfinate;hydron?
fluoromethanesulfinate;hydron has a molecular weight of 98.10 g/mol, XLogP of -0.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethanesulfinate;hydron is sourced from PubChem (CID 174471713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).