Molecule record

2-CHLOROPENTANE

C5H11Cl

106.59 g/mol

2D structure for 2-CHLOROPENTANE

Molecular properties

Formula
C5H11Cl
Molar mass
106.59 g·mol−1
Exact mass
106.0549 Da
0
0
0
0.00 Ų
2.5 (PubChem computed XLogP3-AA descriptor)
CAS
625-29-6
PubChem CID
12245

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
Logp2.5PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 1-Methylbutyl chloride
  • 1Methylbutyl chloride
  • 2-Chloropentane, 95%
  • 2-chloro-pentane
  • 210-885-7
  • 2ESE4BEL55
  • 625-29-6
  • DTXCID50818410
Show all 22 synonyms
  • DTXSID90870714
  • EINECS 210-885-7
  • NFRKUDYZEVQXTE-UHFFFAOYSA-N
  • NSC 7899
  • NSC-7899
  • NSC7899
  • Pentane, 2-chloro-
  • Pentane, 2chloro
  • RefChem:86519
  • SCHEMBL1723477
  • SCHEMBL42743
  • SCHEMBL84325
  • SCHEMBL84326
  • sec-Amyl chloride

Structure identifiers

Canonical SMILES
CCCC(C)Cl
Isomeric SMILES
CCCC(C)Cl
InChI
InChI=1S/C5H11Cl/c1-3-4-5(2)6/h5H,3-4H2,1-2H3
InChIKey
NFRKUDYZEVQXTE-UHFFFAOYSA-N
PubChem CID
12245

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 2-CHLOROPENTANE; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-CHLOROPENTANE; 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