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Molecule record

3-chloro-1H-indole

C8H6ClN

151.60 g/mol

Loading structure

Molecular properties

Formula
C8H6ClN
Molar mass
151.60 g·mol−1
Exact mass
151.0189 Da
6
PubChem CID
177790

Functional groups

Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 16863-96-0
  • 1H-Indole,3-chloro-
  • 1H-indole, 3-chloro-
  • 3-Chloroindole
  • 834-195-6
  • AC-25149
  • AKOS006237649
  • DTXCID301366076
Show all 24 synonyms
  • DTXSID50937514
  • GVSMQKKMAYLKMM-UHFFFAOYSA-N
  • InChI=1/C8H6ClN/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5,10
  • MFCD09250863
  • RefChem:499653
  • SB40496
  • SCHEMBL1639050
  • SCHEMBL2159745
  • SCHEMBL29621606
  • SCHEMBL29621607
  • SCHEMBL3928782
  • SCHEMBL399039
  • SCHEMBL4461828
  • SCHEMBL4682957
  • TN7200
  • orb1296806

Structure identifiers

Canonical SMILES
Clc1c[nH]c2ccccc12
Isomeric SMILES
C1=CC=C2C(=C1)C(=CN2)Cl
InChI
InChI=1S/C8H6ClN/c9-7-5-10-8-4-2-1-3-6(7)8/h1-5,10H
InChIKey
GVSMQKKMAYLKMM-UHFFFAOYSA-N
PubChem CID
177790

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 3-chloro-1H-indole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-chloro-1H-indole; 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