2H-Pyrazolo(3,4-c)(2,1)benzothiazepin-4(9H)-one, 2,9-dimethyl-, O-(2-( 1-pyrrolidinyl)ethyl)oxime, 10,10-dioxide, (Z)-2-butenedioate (1:1)

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Names

[ CAS No. ]:
181145-48-2

[ Name ]:
2H-Pyrazolo(3,4-c)(2,1)benzothiazepin-4(9H)-one, 2,9-dimethyl-, O-(2-( 1-pyrrolidinyl)ethyl)oxime, 10,10-dioxide, (Z)-2-butenedioate (1:1)

Chemical & Physical Properties

[ Boiling Point ]:
568.7ºC at 760mmHg

[ Molecular Formula ]:
C22H27N5O7S

[ Molecular Weight ]:
505.54400

[ Flash Point ]:
297.7ºC

[ Exact Mass ]:
505.16300

[ PSA ]:
163.01000

[ LogP ]:
2.21890

[ Vapour Pressure ]:
6.02E-13mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ9829820
CAS REGISTRY NUMBER :
181145-48-2
LAST UPDATED :
199806
DATA ITEMS CITED :
1

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 :
700 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARPMAS Archiv der Pharmazie (Weinheim, Germany) (VCH Pub., Inc., 303 NW 12th Ave., Deerfield Beach, FL 33441) V.51-261, 1835-1923; V.305- 1972- Volume(issue)/page/year: 329,352,1996

Related Compounds

  • 3-(2,2-Dimethyl-1,3-dioxolan-4-yl)-2-hydroxy-3-methylbutanoic acid
  • 3-[2-(Methoxymethyl)-1,3-thiazol-4-yl]-3-methylbutan-1-amine
  • 3-(2-Methoxyquinolin-3-yl)-2,2-dimethylcyclopropan-1-amine
  • rac-(1R,3R)-2,2-dimethyl-3-[5-(trifluoromethyl)furan-2-yl]cyclopropane-1-carboxylic acid
  • rac-(1R,3S)-3-(6-methoxypyridin-2-yl)-2,2-dimethylcyclopropan-1-amine
  • 2-[4-(Methoxymethyl)phenyl]-1-methylpiperazine
  • 4-(2-Chloro-6-methylpyridin-4-yl)-1,3-thiazol-2-amine
  • 2-[2-(Dimethylamino)pyridin-3-yl]butanedioic acid
  • 3-(Azetidin-3-yloxy)-4-methylpyridine
  • 1-{1-[(2,4,5-Trifluorophenyl)methyl]cyclopropyl}ethan-1-amine