Pyrosulfuryl chloride

Cl2O5S2 — CID 24649

IUPAC—
SMILESO=S(=O)(Cl)OS(=O)(=O)Cl
InChIInChI=1S/Cl2O5S2/c1-8(3,4)7-9(2,5)6
InChIKeyNNTJKSMVNWGFTB-UHFFFAOYSA-N
MW215.03 g/mol
LogP-0.03
Rot. Bonds2

About Pyrosulfuryl chloride

Pyrosulfuryl chloride (PubChem CID 24649) has the molecular formula Cl2O5S2 and a molecular weight of 215.03 g/mol.

Molecular Properties

Compound NamePyrosulfuryl chloride
PubChem CID24649
Molecular FormulaCl2O5S2
Molecular Weight215.03 g/mol
Exact Mass213.86
IUPAC Name—
SMILESO=S(=O)(Cl)OS(=O)(=O)Cl
InChIInChI=1S/Cl2O5S2/c1-8(3,4)7-9(2,5)6
InChIKeyNNTJKSMVNWGFTB-UHFFFAOYSA-N
XLogP-0.03
TPSA77.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.03
LogP ≤ 5-0.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze Pyrosulfuryl chloride 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

CID 15787726
CID 15787726
CID 15787728
CID 15787728
CID 15787729
CID 15787729
CID 15787730
CID 15787730
CID 15787731
CID 15787731
CID 17977377
CID 17977377
CID 18378143
CID 18378143
CID 20658998
CID 20658998
CID 21392413
CID 21392413
CID 23284093
CID 23284093
CID 57940052
CID 57940052
CID 101282780
CID 101282780

Frequently Asked Questions

What is the IUPAC name of Pyrosulfuryl chloride?
The IUPAC name of Pyrosulfuryl chloride (CID 24649) is not available.
What is the SMILES notation for Pyrosulfuryl chloride?
The canonical SMILES for Pyrosulfuryl chloride is O=S(=O)(Cl)OS(=O)(=O)Cl.
What is the InChIKey of Pyrosulfuryl chloride?
The InChIKey is NNTJKSMVNWGFTB-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl2O5S2/c1-8(3,4)7-9(2,5)6.
What are the key properties of Pyrosulfuryl chloride?
Pyrosulfuryl chloride has a molecular weight of 215.03 g/mol, XLogP of -0.03, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for Pyrosulfuryl chloride is sourced from PubChem (CID 24649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).