hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane

H2O4S5 — CID 175982977

IUPAChydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane
SMILESO=S(O)(=S)SS(=O)(O)=S
InChIInChI=1S/H2O4S5/c1-8(2,5)7-9(3,4)6/h(H,1,2,5)(H,3,4,6)
InChIKeyXMZITAJOSATXAI-UHFFFAOYSA-N
MW226.35 g/mol
LogP-0.01
Rot. Bonds2

About hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane

hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane (PubChem CID 175982977) has the molecular formula H2O4S5 and a molecular weight of 226.35 g/mol. Its IUPAC name is hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane.

Molecular Properties

Compound Namehydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane
PubChem CID175982977
Molecular FormulaH2O4S5
Molecular Weight226.35 g/mol
Exact Mass225.86
IUPAC Namehydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane
SMILESO=S(O)(=S)SS(=O)(O)=S
InChIInChI=1S/H2O4S5/c1-8(2,5)7-9(3,4)6/h(H,1,2,5)(H,3,4,6)
InChIKeyXMZITAJOSATXAI-UHFFFAOYSA-N
XLogP-0.01
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

platinum;sulfurothioic O-acid
CID 173374995
gallane;sulfurothioic O-acid
CID 175433245
sulfurothioic O-acid;uranium
CID 174777711
sulfurothioic O-acid;titanium
CID 174806417
CID 173149311
CID 173149311
azane;sulfane;sulfurothioic O-acid
CID 172705042
CID 170843426
CID 170843426
disodium;hydride;bis(sulfurothioic O-acid)
CID 173307692
platinum;sulfuric acid;tetrahydrate
CID 131883452
strontium;gallane;hydride;sulfurothioic O-acid
CID 173373507
CID 174680550
CID 174680550
sodium;hydride;sulfane;sulfurothioic O-acid
CID 174251415

Frequently Asked Questions

What is the IUPAC name of hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane?
The IUPAC name of hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane (CID 175982977) is hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane.
What is the SMILES notation for hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane?
The canonical SMILES for hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane is O=S(O)(=S)SS(=O)(O)=S.
What is the InChIKey of hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane?
The InChIKey is XMZITAJOSATXAI-UHFFFAOYSA-N. The full InChI is InChI=1S/H2O4S5/c1-8(2,5)7-9(3,4)6/h(H,1,2,5)(H,3,4,6).
What are the key properties of hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane?
hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane has a molecular weight of 226.35 g/mol, XLogP of -0.01, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-hydroxysulfonothioylsulfanyl-oxo-sulfanylidene-λ6-sulfane is sourced from PubChem (CID 175982977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).