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Molecule record

CHLOROACETYL CHLORIDE

C2H2Cl2O

112.94 g/mol

2D structure for CHLOROACETYL CHLORIDE

Molecular properties

Formula
C2H2Cl2O
Molar mass
112.94 g·mol−1
Exact mass
111.9483 Da
1
0
1
17.10 Ų
1.4 (PubChem computed XLogP3-AA descriptor)
CAS
79-04-9
PubChem CID
6577

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

Acid chloride

Physical properties

PropertyValueConditionsSource
Logp1.4PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • .alpha.-Chloroacetyl chloride
  • 2-chloroacetyl chloride
  • 201-171-6
  • 79-04-9
  • Acetyl chloride, 2-chloro-
  • Acetyl chloride, chloro-
  • Chloracetyl chloride
  • Chlorid kyseliny chloroctove
Show all 22 synonyms
  • Chloroacetic acid chloride
  • Chloroacetic chloride
  • ChloroacetylChloride
  • Chloroethanoyl chloride
  • Chlorure de chloracetyle
  • DTXCID306472
  • DTXSID4026472
  • K5UML06YUO
  • MFCD00000725
  • Monochloroacetyl chloride
  • RefChem:125361
  • chloracetylchloride
  • chloro acetyl chloride
  • monochloroacetic acid chloride

Structure identifiers

Canonical SMILES
C(C(=O)Cl)Cl
Isomeric SMILES
C(C(=O)Cl)Cl
InChI
InChI=1S/C2H2Cl2O/c3-1-2(4)5/h1H2
InChIKey
VGCXGMAHQTYDJK-UHFFFAOYSA-N
PubChem CID
6577

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 CHLOROACETYL CHLORIDE; not experimental data.

Simulated EI mass spectrum

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

Sources

Molecule identity

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

PubChem(link only)
Open source record
CHLOROACETYL CHLORIDE - Formula, Structure, Properties | ChemArche