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Molecule record

3-chloropentane

C5H11Cl

106.60 g/mol

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Molecular properties

Formula
C5H11Cl
Molar mass
106.60 g·mol−1
Exact mass
106.0549 Da
0
PubChem CID
12016

Functional groups

Alkane / alkyl carbon
Alkyl halide

Physical properties

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

Common names and synonyms

  • 1-Ethylpropyl chloride
  • 210-467-4
  • 3-Chloro-pentane
  • 616-20-6
  • AKOS009235751
  • BP-10944
  • CHEMBL18780
  • CXQSCYIVCSCSES-UHFFFAOYSA-N
Show all 21 synonyms
  • DB-053951
  • DTXCID8043078
  • DTXSID3060661
  • EINECS 210-467-4
  • InChI=1/C5H11Cl/c1-3-5(6)4-2/h5H,3-4H2,1-2H
  • NS00034750
  • Pentane, 3-chloro-
  • RefChem:93523
  • SCHEMBL235333
  • SCHEMBL611506
  • SCHEMBL6978018
  • SCHEMBL83190
  • SCHEMBL83191

Structure identifiers

Canonical SMILES
CCC(Cl)CC
Isomeric SMILES
CCC(CC)Cl
InChI
InChI=1S/C5H11Cl/c1-3-5(6)4-2/h5H,3-4H2,1-2H3
InChIKey
CXQSCYIVCSCSES-UHFFFAOYSA-N
PubChem CID
12016

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-chloropentane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-chloropentane; 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