Molecule record

1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene

C14H9Cl5

354.49 g/mol

Loading structure

Molecular properties

Formula
C14H9Cl5
Molar mass
354.49 g·mol−1
Exact mass
351.9147 Da
8
PubChem CID
3036

Functional groups

Alkane / alkyl carbon
Alkyl halide
Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 4,4'-DDT
  • 50-29-3
  • Agritan
  • Anofex
  • Arkotine
  • Benzochloryl
  • Bovidermol
  • Chlorophenothane
Show all 24 synonyms
  • Chlorphenothan
  • Chlorphenotoxum
  • Clofenotane
  • DDT
  • Dicophane
  • Estonate
  • Genitox
  • Gesarol
  • Guesarol
  • Neocid
  • Parachlorocidum
  • Pentachlorin
  • RefChem:127031
  • Zerdane
  • dichlorodiphenyltrichloroethane
  • p,p'-DDT

Structure identifiers

Canonical SMILES
Clc1ccc(C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl)cc1
Isomeric SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl)Cl
InChI
InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H
InChIKey
YVGGHNCTFXOJCH-UHFFFAOYSA-N
PubChem CID
3036

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-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-chloro-4-[2,2,2-trichloro-1-(4-chlorophenyl)ethyl]benzene; 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