Molecule record

THIONYL CHLORIDE

Cl2OS

118.97 g/mol

2D structure for THIONYL CHLORIDE

Molecular properties

Formula
Cl2OS
Molar mass
118.97 g·mol−1
Exact mass
117.9047 Da
0
0
2
36.30 Ų
1.5 (PubChem computed XLogP3-AA descriptor)
CAS
7719-09-7
PubChem CID
24386

Interactions

Polarity
Often weakly polar or nonpolar unless other structural features dominate.
Acid-base behavior
Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
Intermolecular forces
Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.

Functional groups

No functional-group assignment has been curated yet.

Physical properties

PropertyValueConditionsSource
Logp1.5PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 231-748-8
  • 4A8YJA13N4
  • 682-671-5
  • 7719-09-7
  • CHEBI:29290
  • DTXCID0047953
  • DTXSID3064778
  • Dichlorosulfoxide
Show all 22 synonyms
  • MFCD00011449
  • RefChem:6303
  • SOCl2
  • Sulfinyl chloride
  • Sulfinyl dichloride
  • Sulfur chloride oxide
  • Sulfur chloride oxide (Cl2SO)
  • Sulfur oxychloride
  • Sulfurous dichloride
  • Sulfurous oxychloride
  • Thionyl chloride, ReagentPlus(R), >=99%
  • Thionyl dichloride
  • Thionylchloride
  • thionylchioride

Structure identifiers

Canonical SMILES
O=S(Cl)Cl
Isomeric SMILES
O=S(Cl)Cl
InChI
InChI=1S/Cl2OS/c1-4(2)3
InChIKey
FYSNRJHAOHDILO-UHFFFAOYSA-N
PubChem CID
24386

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for THIONYL CHLORIDE; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for THIONYL CHLORIDE; not experimental data.

Sources

Molecule identity

Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record