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Molecule record

1-chloro-2-methylbenzene

C7H7Cl

126.59 g/mol

Loading structure

Molecular properties

Formula
C7H7Cl
Molar mass
126.59 g·mol−1
Exact mass
126.0236 Da
4
PubChem CID
7238

Functional groups

Alkane / alkyl carbon
Aromatic ring
Aryl halide

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1-METHYL-2-CHLOROBENZENE
  • 1-chloranyl-2-methyl-benzene
  • 1-chloro-2-methyl-benzene
  • 2-Chloro-1-methylbenzene
  • 2-Chlorotoluene
  • 2-Methylchlorobenzene
  • 202-424-3
  • 2G7D0YDV9H
Show all 24 synonyms
  • 95-49-8
  • Benzene, 1-chloro-2-methyl-
  • C7H7Cl
  • DTXCID003977
  • DTXSID8023977
  • Halso 99
  • MFCD00000562
  • NSC-8766
  • O-METHYLCHLOROBENZENE
  • RefChem:86544
  • Toluene, o-chloro-
  • UN-2238
  • UN2238
  • o-Chlorotoluene
  • o-Tolyl chloride
  • ortho-Chlorotoluene

Structure identifiers

Canonical SMILES
Cc1ccccc1Cl
Isomeric SMILES
CC1=CC=CC=C1Cl
InChI
InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3
InChIKey
IBSQPLPBRSHTTG-UHFFFAOYSA-N
PubChem CID
7238

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 1-chloro-2-methylbenzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-chloro-2-methylbenzene; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record