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126598-25-2

126598-25-2 structure
126598-25-2 structure

Name 2-[3-(1,3-benzodioxol-5-yl)-6-(4-chlorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl]acetic acid
Density 1.7g/cm3
Boiling Point 693.9ºC at 760 mmHg
Molecular Formula C19H13ClN4O4S
Molecular Weight 428.84900
Flash Point 373.5ºC
Exact Mass 428.03500
PSA 124.13000
LogP 2.96420
Vapour Pressure 3.26E-20mmHg at 25°C
Index of Refraction 1.796

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ6158204
CHEMICAL NAME :
7H-1,2,4-Triazolo(3,4-b)(1,3,4)thiadiazine-7-acetic acid, 3-(1,3-benzodioxol-5-yl)- 6-(4-chlorophenyl)-
CAS REGISTRY NUMBER :
126598-25-2
LAST UPDATED :
199206
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C19-H13-Cl-N4-O4-S
MOLECULAR WEIGHT :
428.87

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 :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 44,933,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 44,933,1989