86617-08-5

86617-08-5 structure
86617-08-5 structure

Name methyl (2S,4R)-6-chloro-4-methyl-4-thiophen-2-yl-1,3-benzodioxine-2-carboxylate
Density 1.353g/cm3
Boiling Point 455ºC at 760 mmHg
Molecular Formula C15H13ClO4S
Molecular Weight 324.77900
Flash Point 229ºC
Exact Mass 324.02200
PSA 73.00000
LogP 3.57310
Index of Refraction 1.583

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DF3509700
CHEMICAL NAME :
1,3-Benzodioxan-2-carboxylic acid, 6-chloro-4-methyl-4-(2-thienyl)-, methyl ester, (E)-
CAS REGISTRY NUMBER :
86617-08-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H13-Cl-O4-S
MOLECULAR WEIGHT :
324.79

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 :
600 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 18,67,1983

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86617-08-5 structure

86617-08-5

Literature: Humbert; Dagnaux; Cohen; et al. European Journal of Medicinal Chemistry, 1983 , vol. 18, # 1 p. 67 - 78

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86617-08-5 structure

86617-08-5

Literature: Humbert; Dagnaux; Cohen; et al. European Journal of Medicinal Chemistry, 1983 , vol. 18, # 1 p. 67 - 78