Molecule record

1-[2-(2,4-dichlorophenyl)pentyl]-1,2,4-triazole

C13H15Cl2N3

284.19 g/mol

Loading structure

Molecular properties

Formula
C13H15Cl2N3
Molar mass
284.19 g·mol−1
Exact mass
283.0643 Da
7
PubChem CID
91693

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-(2,4-dichloro-beta-propylphenethyl)-1H-1,2,4-triazole
  • 1-(2-(2,4-Dichlorophenyl)pentyl)-1H-1,2,4-triazole
  • 1H-1,2,4-Triazole, 1-[2-(2,4-dichlorophenyl)pentyl]-
  • 266-275-6
  • 3UN9F9ZJ43
  • 66246-88-6
  • Award
  • BRN 0541488
Show all 24 synonyms
  • CGA-71818
  • CHEBI:81970
  • DTXCID6022260
  • DTXSID8042260
  • EINECS 266-275-6
  • Gold Topaz
  • Gold Topaz 8121
  • MFCD00078737
  • Onmex
  • Penconazole
  • Penconazole [BSI:ISO]
  • RefChem:56368
  • Topaz
  • Topaze
  • Topaze C
  • topas

Structure identifiers

Canonical SMILES
CCCC(Cn1cncn1)c1ccc(Cl)cc1Cl
Isomeric SMILES
CCCC(CN1C=NC=N1)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3
InChIKey
WKBPZYKAUNRMKP-UHFFFAOYSA-N
PubChem CID
91693

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-[2-(2,4-dichlorophenyl)pentyl]-1,2,4-triazole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-[2-(2,4-dichlorophenyl)pentyl]-1,2,4-triazole; not experimental data.

Sources

Molecule identity

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

Open source record