2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid

Modify Date: 2024-04-04 19:56:42

2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid Structure
2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid structure
 Common Name 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
CAS Number 160893-95-8 Molecular Weight 239.29400
Density 1.449g/cm3 Boiling Point 419.4ºC at 760mmHg
Molecular Formula C10H13N3O2S Melting Point N/A
MSDS N/A Flash Point 207.4ºC

 Names

Name 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.449g/cm3
Boiling Point 419.4ºC at 760mmHg
Molecular Formula C10H13N3O2S
Molecular Weight 239.29400
Flash Point 207.4ºC
Exact Mass 239.07300
PSA 106.58000
LogP 1.59300
Vapour Pressure 8.76E-08mmHg at 25°C
Index of Refraction 1.674

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GW4567550
CHEMICAL NAME :
1-Cyclohexene-1-carboxylic acid, 2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-
CAS REGISTRY NUMBER :
160893-95-8
LAST UPDATED :
199603
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C10-H13-N3-O2-S
MOLECULAR WEIGHT :
239.32

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 :
PHARAT Pharmazie. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem. Rep.) V.1- 1946- Volume(issue)/page/year: 49,880,1994
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 :
PHARAT Pharmazie. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem. Rep.) V.1- 1946- Volume(issue)/page/year: 49,880,1994

 Synthetic Route

2-methyl-6,7,8,9-tetrahydro-[1,3,4]thiadiazolo[2,3-b]quinazolin-5-one structure

2-methyl-6,7,8,...

CAS#:116805-48-2

~30%

2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid Structure

2-[(5-methyl-1,...

CAS#:160893-95-8

Literature: Santagati; Modica; Russo; Cutuli; Di Pietro; Amico-Roxas Pharmazie, 1994 , vol. 49, # 12 p. 880 - 884

 Synonyms

1-Cyclohexene-1-carboxylic acid,2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)
2-((5-Methyl-1,3,4-thiadiazol-2-yl)amino)-1-cyclohexene-1-carboxylic acid
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Chemsrc provides CAS#:160893-95-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid>> amp version: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]cyclohexene-1-carboxylic acid

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