5-Hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-1H-pyrazole-4-acetic a cid

Modify Date: 2024-01-04 00:32:53

5-Hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-1H-pyrazole-4-acetic a cid Structure
5-Hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-1H-pyrazole-4-acetic a cid structure
Common Name 5-Hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-1H-pyrazole-4-acetic a cid
CAS Number 84968-81-0 Molecular Weight 334.30700
Density 1.617g/cm3 Boiling Point 639ºC at 760 mmHg
Molecular Formula C13H10N4O5S Melting Point N/A
MSDS N/A Flash Point 340.3ºC

 Names

Name 2-[5-methyl-2-(6-nitro-1,3-benzothiazol-2-yl)-3-oxo-1H-pyrazol-4-yl]acetic acid

 Chemical & Physical Properties

Density 1.617g/cm3
Boiling Point 639ºC at 760 mmHg
Molecular Formula C13H10N4O5S
Molecular Weight 334.30700
Flash Point 340.3ºC
Exact Mass 334.03700
PSA 162.04000
LogP 2.14220
Index of Refraction 1.717

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ4922500
CHEMICAL NAME :
1H-Pyrazole-4-acetic acid, 5-hydroxy-3-methyl-1-(6-nitro-2-benzothiazolyl)-
CAS REGISTRY NUMBER :
84968-81-0
LAST UPDATED :
198906
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H10-N4-O5-S
MOLECULAR WEIGHT :
334.33

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
700 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 21,869,1982