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

Names

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

[Synonym ]:
1-Cyclohexene-1-carboxylic acid,2-((5-ethyl-1,3,4-thiadiazol-2-yl)amino)
2-((5-Ethyl-1,3,4-thiadiazol-2-yl)amino)-1-cyclohexene-1-carboxylic acid

Chemical & Physical Properties

[ Density]:
1.394g/cm3

[ Boiling Point ]:
428.3ºC at 760mmHg

[ Molecular Formula ]:
C₁₁H₁₅N₃O₂S

[ Molecular Weight ]:
253.32100

[ Flash Point ]:
212.8ºC

[ Exact Mass ]:
253.08800

[ PSA ]:
106.58000

[ LogP ]:
1.84700

[ Vapour Pressure ]:
4.27E-08mmHg at 25°C

[ Index of Refraction ]:
1.655

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: GW4535000

CHEMICAL NAME :: 1-Cyclohexene-1-carboxylic acid, 2-((5-ethyl-1,3,4-thiadiazol-2-yl)amino)-

CAS REGISTRY NUMBER :: 160893-96-9

LAST UPDATED :: 199603

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C11-H15-N3-O2-S

MOLECULAR WEIGHT :: 253.35

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

Click to get detail synthetic route

Related Compounds

9-Tert-butyl-4-methyl-2-azaspiro[4.5]decan-6-one
3-Bromo-2-(but-3-yn-2-yl)pyridine
N-[1-(azetidin-3-yl)ethyl]-3-methoxypropanamide
tert-butyl N-[1-(2-bromo-3-hydroxyphenyl)-2-oxoethyl]carbamate
3-(1,5-dimethyl-1H-pyrazol-3-yl)-2,2-difluoropropanoic acid
tert-butyl N-{3-amino-2-[4-(dimethylamino)phenyl]propyl}carbamate
2-chloro-5-[(2S)-oxiran-2-yl]furan
(1R)-2-amino-1-(2-bromo-3-methoxyphenyl)ethan-1-ol
methyl (3R)-3-hydroxy-3-(6-methylpyridin-2-yl)propanoate
3-[5-(10-Hydroxydec-1-ynyl)-1-oxo-isoindolin-2-yl]piperidine-2,6-dione

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