sulfuric acid;trihydrochloride

H5Cl3O4S — CID 21419907

IUPACsulfuric acid;trihydrochloride
SMILESCl.Cl.Cl.O=S(=O)(O)O
InChIInChI=1S/3ClH.H2O4S/c;;;1-5(2,3)4/h3*1H;(H2,1,2,3,4)
InChIKeyZOBLCVKESRYZRS-UHFFFAOYSA-N
MW207.46 g/mol
LogP0.61
Rot. Bonds

About sulfuric acid;trihydrochloride

sulfuric acid;trihydrochloride (PubChem CID 21419907) has the molecular formula H5Cl3O4S and a molecular weight of 207.46 g/mol. Its IUPAC name is sulfuric acid;trihydrochloride.

Molecular Properties

Compound Namesulfuric acid;trihydrochloride
PubChem CID21419907
Molecular FormulaH5Cl3O4S
Molecular Weight207.46 g/mol
Exact Mass205.90
IUPAC Namesulfuric acid;trihydrochloride
SMILESCl.Cl.Cl.O=S(=O)(O)O
InChIInChI=1S/3ClH.H2O4S/c;;;1-5(2,3)4/h3*1H;(H2,1,2,3,4)
InChIKeyZOBLCVKESRYZRS-UHFFFAOYSA-N
XLogP0.61
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.46
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze sulfuric acid;trihydrochloride 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

copper;sulfuric acid;hydrochloride
CID 175285383
azane;sulfuric acid;dihydrochloride
CID 173220026
calcium;hydride;sulfuric acid;hydrochloride
CID 173159750
copper;nickel;sulfuric acid;hydrochloride
CID 173422635
sulfuric acid;zinc;zirconium;dihydrochloride
CID 174815455
dicalcium;hydride;sulfuric acid;hydrochloride
CID 173127277
sodium;sulfuric acid;hydroxide;hydrochloride
CID 159136854
iron;sulfuric acid;zirconium;tetrahydrochloride
CID 174734672
nickel;sulfuric acid;hydrochloride;hydrofluoride
CID 175187360
alumane;sulfuric acid
CID 173042837
cerium;sulfuric acid
CID 45051640
sulfuric acid;zinc
CID 173312320

Frequently Asked Questions

What is the IUPAC name of sulfuric acid;trihydrochloride?
The IUPAC name of sulfuric acid;trihydrochloride (CID 21419907) is sulfuric acid;trihydrochloride.
What is the SMILES notation for sulfuric acid;trihydrochloride?
The canonical SMILES for sulfuric acid;trihydrochloride is Cl.Cl.Cl.O=S(=O)(O)O.
What is the InChIKey of sulfuric acid;trihydrochloride?
The InChIKey is ZOBLCVKESRYZRS-UHFFFAOYSA-N. The full InChI is InChI=1S/3ClH.H2O4S/c;;;1-5(2,3)4/h3*1H;(H2,1,2,3,4).
What are the key properties of sulfuric acid;trihydrochloride?
sulfuric acid;trihydrochloride has a molecular weight of 207.46 g/mol, XLogP of 0.61, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sulfuric acid;trihydrochloride is sourced from PubChem (CID 21419907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).