sulfonylsulfamic acid

HNO5S2 — CID 19711037

IUPACsulfonylsulfamic acid
SMILESO=S(=O)=NS(=O)(=O)O
InChIInChI=1S/HNO5S2/c2-7(3)1-8(4,5)6/h(H,4,5,6)
InChIKeyYBFXYSJDLKVNHK-UHFFFAOYSA-N
MW159.14 g/mol
LogP-1.15
Rot. Bonds1

About sulfonylsulfamic acid

sulfonylsulfamic acid (PubChem CID 19711037) has the molecular formula HNO5S2 and a molecular weight of 159.14 g/mol. Its IUPAC name is sulfonylsulfamic acid.

Molecular Properties

Compound Namesulfonylsulfamic acid
PubChem CID19711037
Molecular FormulaHNO5S2
Molecular Weight159.14 g/mol
Exact Mass158.93
IUPAC Namesulfonylsulfamic acid
SMILESO=S(=O)=NS(=O)(=O)O
InChIInChI=1S/HNO5S2/c2-7(3)1-8(4,5)6/h(H,4,5,6)
InChIKeyYBFXYSJDLKVNHK-UHFFFAOYSA-N
XLogP-1.15
TPSA100.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.14
LogP ≤ 5-1.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

CID 174779824
CID 174779824
CID 158691877
CID 158691877
CID 174910696
CID 174910696
CID 157097916
CID 157097916
sulfuric acid;sulfurous acid
CID 172712432
(sulfonylamino)sulfonylurea
CID 150349786
CID 150548922
CID 150548922
CID 174708541
CID 174708541
sulfamic acid;sulfurous acid
CID 159581131
calcium;hydride;sulfuric acid;sulfurous acid
CID 173085822
silver;sulfurothioic O-acid;sulfurous acid
CID 173330609
hydrogen peroxide;sulfurothioic O-acid;sulfurous acid
CID 18783594

Frequently Asked Questions

What is the IUPAC name of sulfonylsulfamic acid?
The IUPAC name of sulfonylsulfamic acid (CID 19711037) is sulfonylsulfamic acid.
What is the SMILES notation for sulfonylsulfamic acid?
The canonical SMILES for sulfonylsulfamic acid is O=S(=O)=NS(=O)(=O)O.
What is the InChIKey of sulfonylsulfamic acid?
The InChIKey is YBFXYSJDLKVNHK-UHFFFAOYSA-N. The full InChI is InChI=1S/HNO5S2/c2-7(3)1-8(4,5)6/h(H,4,5,6).
What are the key properties of sulfonylsulfamic acid?
sulfonylsulfamic acid has a molecular weight of 159.14 g/mol, XLogP of -1.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sulfonylsulfamic acid is sourced from PubChem (CID 19711037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).