dihydroxy(sulfanylidene)-λ4-sulfane;methane

CH6O2S2 — CID 88995726

IUPACdihydroxy(sulfanylidene)-λ4-sulfane;methane
SMILESC.OS(O)=S
InChIInChI=1S/CH4.H2O2S2/c;1-4(2)3/h1H4;(H2,1,2,3)
InChIKeyCPXZJSCOVHCIIW-UHFFFAOYSA-N
MW114.19 g/mol
LogP0.65
Rot. Bonds

About dihydroxy(sulfanylidene)-λ4-sulfane;methane

dihydroxy(sulfanylidene)-λ4-sulfane;methane (PubChem CID 88995726) has the molecular formula CH6O2S2 and a molecular weight of 114.19 g/mol. Its IUPAC name is dihydroxy(sulfanylidene)-λ4-sulfane;methane.

Molecular Properties

Compound Namedihydroxy(sulfanylidene)-λ4-sulfane;methane
PubChem CID88995726
Molecular FormulaCH6O2S2
Molecular Weight114.19 g/mol
Exact Mass113.98
IUPAC Namedihydroxy(sulfanylidene)-λ4-sulfane;methane
SMILESC.OS(O)=S
InChIInChI=1S/CH4.H2O2S2/c;1-4(2)3/h1H4;(H2,1,2,3)
InChIKeyCPXZJSCOVHCIIW-UHFFFAOYSA-N
XLogP0.65
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

dihydroxy(sulfanylidene)-λ4-sulfane;periodic acid
CID 158266824
tert-butyl-hydroxy-sulfanylidene-lambda4-sulfane
CID 14319346
hexa-1,4-dien-3-yl-hydroxy-sulfanylidene-λ4-sulfane
CID 154327842
[ethyl(hydroxysulfinothioyl)amino]ethane
CID 87078499
CID 162004424
CID 162004424
hydron;sulfurous acid
CID 173020149
CID 139595971
CID 139595971
iron;sulfurous acid
CID 175438968
phosphane;sulfurous acid
CID 173229936
arsane;sulfurous acid
CID 173343664
CID 86742114
CID 86742114
hydrogen peroxide;sulfurothioic O-acid;sulfurous acid
CID 18783594

Frequently Asked Questions

What is the IUPAC name of dihydroxy(sulfanylidene)-λ4-sulfane;methane?
The IUPAC name of dihydroxy(sulfanylidene)-λ4-sulfane;methane (CID 88995726) is dihydroxy(sulfanylidene)-λ4-sulfane;methane.
What is the SMILES notation for dihydroxy(sulfanylidene)-λ4-sulfane;methane?
The canonical SMILES for dihydroxy(sulfanylidene)-λ4-sulfane;methane is C.OS(O)=S.
What is the InChIKey of dihydroxy(sulfanylidene)-λ4-sulfane;methane?
The InChIKey is CPXZJSCOVHCIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4.H2O2S2/c;1-4(2)3/h1H4;(H2,1,2,3).
What are the key properties of dihydroxy(sulfanylidene)-λ4-sulfane;methane?
dihydroxy(sulfanylidene)-λ4-sulfane;methane has a molecular weight of 114.19 g/mol, XLogP of 0.65, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(sulfanylidene)-λ4-sulfane;methane is sourced from PubChem (CID 88995726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).