fluoro-(methyldisulfanyl)methane

C2H5FS2 — CID 574430

IUPACfluoro-(methyldisulfanyl)methane
SMILESCSSCF
InChIInChI=1S/C2H5FS2/c1-4-5-2-3/h2H2,1H3
InChIKeyXZROFZQMUJTJEH-UHFFFAOYSA-N
MW112.19 g/mol
LogP1.92
Rot. Bonds2

About fluoro-(methyldisulfanyl)methane

fluoro-(methyldisulfanyl)methane (PubChem CID 574430) has the molecular formula C2H5FS2 and a molecular weight of 112.19 g/mol. Its IUPAC name is fluoro-(methyldisulfanyl)methane.

Molecular Properties

Compound Namefluoro-(methyldisulfanyl)methane
PubChem CID574430
Molecular FormulaC2H5FS2
Molecular Weight112.19 g/mol
Exact Mass111.98
IUPAC Namefluoro-(methyldisulfanyl)methane
SMILESCSSCF
InChIInChI=1S/C2H5FS2/c1-4-5-2-3/h2H2,1H3
InChIKeyXZROFZQMUJTJEH-UHFFFAOYSA-N
XLogP1.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.19
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(methyldisulfanyl)-2-[2-(methyldisulfanyl)ethylsulfanyl]ethane
CID 165390493
1-(methyldisulfanyl)propane
CID 16592
(ethyldisulfanyl)ethane;(methyldisulfanyl)methane
CID 87339090
(ethyldisulfanyl)ethane;bis((methyldisulfanyl)methane)
CID 159797170
(methyldisulfanyl)methylsulfanylethane
CID 86158213
3-methylsulfanylbutane-1-thiol
CID 173367165
4-(methyldisulfanyl)butan-1-amine
CID 118258387
fluoro(hydroxysulfanyl)methane
CID 57495121
2-methyl-3-(methyldisulfanyl)propan-1-amine
CID 87177035
(methyldisulfanyl)methane;nickel
CID 159414601
2-methyl-1-[(methyldisulfanyl)methoxy]propane
CID 166830923
1-fluoro-3-[(3-fluoro-2-methylpropyl)disulfanyl]-2-methylpropane
CID 174460167

Frequently Asked Questions

What is the IUPAC name of fluoro-(methyldisulfanyl)methane?
The IUPAC name of fluoro-(methyldisulfanyl)methane (CID 574430) is fluoro-(methyldisulfanyl)methane.
What is the SMILES notation for fluoro-(methyldisulfanyl)methane?
The canonical SMILES for fluoro-(methyldisulfanyl)methane is CSSCF.
What is the InChIKey of fluoro-(methyldisulfanyl)methane?
The InChIKey is XZROFZQMUJTJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5FS2/c1-4-5-2-3/h2H2,1H3.
What are the key properties of fluoro-(methyldisulfanyl)methane?
fluoro-(methyldisulfanyl)methane has a molecular weight of 112.19 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-(methyldisulfanyl)methane is sourced from PubChem (CID 574430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).