fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane

C7H7FO2S2 — CID 141038856

IUPACfluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane
SMILESO=S(F)(=S)OCc1ccccc1
InChIInChI=1S/C7H7FO2S2/c8-12(9,11)10-6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyHOWHOQHMTWUZML-UHFFFAOYSA-N
MW206.26 g/mol
LogP1.75
Rot. Bonds3

About fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane

fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane (PubChem CID 141038856) has the molecular formula C7H7FO2S2 and a molecular weight of 206.26 g/mol. Its IUPAC name is fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane.

Molecular Properties

Compound Namefluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane
PubChem CID141038856
Molecular FormulaC7H7FO2S2
Molecular Weight206.26 g/mol
Exact Mass205.99
IUPAC Namefluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane
SMILESO=S(F)(=S)OCc1ccccc1
InChIInChI=1S/C7H7FO2S2/c8-12(9,11)10-6-7-4-2-1-3-5-7/h1-5H,6H2
InChIKeyHOWHOQHMTWUZML-UHFFFAOYSA-N
XLogP1.75
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.26
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane
CID 139915926
benzyl hydrogen sulfate
CID 20818
oxo-phenylmethoxy-propyl-sulfanylidene-λ6-sulfane
CID 139915892
benzyl methanesulfonate;formaldehyde
CID 175233269
sodium benzyl phenylmethanesulfonate
CID 22169271
benzyl hydroxy sulfate
CID 174960485
benzyl N,N-dibenzylsulfamate
CID 22184355
phenylmethoxysulfonylmethanesulfonic acid
CID 86632337
benzyl sulfate;triphenylsulfanium
CID 88922485
benzyl 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate
CID 45379801
CID 158339073
CID 158339073
benzyl 2-amino-2-oxoethanesulfonate
CID 91486530

Frequently Asked Questions

What is the IUPAC name of fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane?
The IUPAC name of fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane (CID 141038856) is fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane.
What is the SMILES notation for fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane?
The canonical SMILES for fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane is O=S(F)(=S)OCc1ccccc1.
What is the InChIKey of fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane?
The InChIKey is HOWHOQHMTWUZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7FO2S2/c8-12(9,11)10-6-7-4-2-1-3-5-7/h1-5H,6H2.
What are the key properties of fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane?
fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane has a molecular weight of 206.26 g/mol, XLogP of 1.75, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-oxo-phenylmethoxy-sulfanylidene-λ6-sulfane is sourced from PubChem (CID 141038856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).