Benzoic acid,2,3,5,6-tetrachloro-

Modify Date: 2025-08-25 09:18:32

Benzoic acid,2,3,5,6-tetrachloro- Structure
Benzoic acid,2,3,5,6-tetrachloro- structure
Common Name Benzoic acid,2,3,5,6-tetrachloro-
CAS Number 50-38-4 Molecular Weight 259.90200
Density 1.735g/cm3 Boiling Point 348ºC at 760mmHg
Molecular Formula C7H2Cl4O2 Melting Point N/A
MSDS Chinese Flash Point 164.3ºC

 Names

Name 2,3,5,6-Tetrachlorobenzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.735g/cm3
Boiling Point 348ºC at 760mmHg
Molecular Formula C7H2Cl4O2
Molecular Weight 259.90200
Flash Point 164.3ºC
Exact Mass 257.88100
PSA 37.30000
LogP 3.99840
Index of Refraction 1.622
InChIKey UYGUFXUBSNDUFA-UHFFFAOYSA-N
SMILES O=C(O)c1c(Cl)c(Cl)cc(Cl)c1Cl

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DH6834000
CHEMICAL NAME :
Benzoic acid, 2,3,5,6-tetrachloro-
CAS REGISTRY NUMBER :
50-38-4
BEILSTEIN REFERENCE NO. :
1968842
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H2-Cl4-O2
MOLECULAR WEIGHT :
259.89
WISWESSER LINE NOTATION :
QVR BG CG EG FG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
237 mg/kg
TOXIC EFFECTS :
Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity
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: 11,1020,1968

 Synthetic Route

~94%

Benzoic acid,2,3,5,6-tetrachloro- Structure

Benzoic acid,2,...

CAS#:50-38-4

Literature: Boogaerts, Ine I. F.; Nolan, Steven P. Journal of the American Chemical Society, 2010 , vol. 132, # 26 p. 8858 - 8859

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Benzoic acid,2,3,5,6-tetrachloro- Structure

Benzoic acid,2,...

CAS#:50-38-4

Literature: Rahman, M. T. Journal of Organometallic Chemistry, 1982 , vol. 225, # 1 p. 25 - 30

 Synonyms

BENZOIC ACID,2,3,5,6-TETRACHLORO
2,5,6-Tetrachlorobenzoic acid
2,3,5,6-Tetrachlor-benzoesaeure
Benzoic acid,3,5,6-tetrachloro
2,3,5,6-tetrachloro-benzoic acid
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