Dodecanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester

Modify Date: 2025-08-25 16:31:53

Dodecanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester Structure
Dodecanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester structure
Common Name Dodecanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester
CAS Number 67205-61-2 Molecular Weight 439.20300
Density 1.28g/cm3 Boiling Point 509.8ºC at 760 mmHg
Molecular Formula C19H23Cl4NO2 Melting Point N/A
MSDS N/A Flash Point 262.1ºC

 Names

Name (2,3,5,6-tetrachloro-4-cyanophenyl) dodecanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.28g/cm3
Boiling Point 509.8ºC at 760 mmHg
Molecular Formula C19H23Cl4NO2
Molecular Weight 439.20300
Flash Point 262.1ºC
Exact Mass 437.04800
PSA 50.09000
LogP 7.99818
Index of Refraction 1.542
InChIKey ZESURNSFEWJIMR-UHFFFAOYSA-N
SMILES CCCCCCCCCCCC(=O)Oc1c(Cl)c(Cl)c(C#N)c(Cl)c1Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
JR3455000
CHEMICAL NAME :
Dodecanoic acid, 4-cyano-2,3,5,6-tetrachlorophenyl ester
CAS REGISTRY NUMBER :
67205-61-2
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C19-H23-Cl4-N-O2
MOLECULAR WEIGHT :
439.23

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

 Synonyms

4-Cyano-2,3,5,6-tetrachlorophenyl dodecanoate
Dodecanoic acid,4-cyano-2,3,5,6-tetrachlorophenyl ester
2,3,5,6-tetrachloro-4-cyanophenyl laurate
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