(2,3,5,6-tetrachloro-4-cyano-phenyl) propanoate

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Names

[ CAS No. ]:
67205-53-2

[ Name ]:
(2,3,5,6-tetrachloro-4-cyano-phenyl) propanoate

[Synonym ]:
4-(1-Oxopropoxy)-2,3,5,6-tetrachlorobenzonitrile
Benzonitrile,4-(1-oxopropoxy)-2,3,5,6-tetrachloro
2,3,5,6-tetrachloro-4-cyanophenyl propionate

Chemical & Physical Properties

[ Density]:
1.59g/cm3

[ Boiling Point ]:
406.3ºC at 760 mmHg

[ Molecular Formula ]:
C10H5Cl4NO2

[ Molecular Weight ]:
312.96400

[ Flash Point ]:
199.5ºC

[ Exact Mass ]:
310.90700

[ PSA ]:
50.09000

[ LogP ]:
4.48728

[ Index of Refraction ]:
1.589

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DI4925000
CHEMICAL NAME :
Benzonitrile, 4-(1-oxopropoxy)-2,3,5,6-tetrachloro-
CAS REGISTRY NUMBER :
67205-53-2
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H5-Cl4-N-O2
MOLECULAR WEIGHT :
312.96

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>300 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 21,906,1978

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Pentachlorobenzonitrile
  • 4-hydroxytetrachlorobenzonitrile
  • Propanoyl chloride

DownStream

Related Compounds

  • 2,3,5,6-tetrachloro-4-phenyl-1,2λ5-benzoxaphosphinine 2-oxide
  • (2,3,5,6-tetrachloro-4-cyanophenyl) pentanoate
  • [2,3,5,6-tetrachloro-4-(prop-2-enoyloxymethyl)phenyl]methyl prop-2-enoate
  • (2,3,5,6-tetrachloro-4-cyanophenyl) hexanoate
  • (2,3,5,6-tetrachloro-4-cyanophenyl) butanoate
  • (2,3,5,6-tetrachloro-4-cyanophenyl) 2-ethylbutanoate