(Z)-but-2-enedioic acid,1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine

Names

[ CAS No. ]:
21699-87-6

[ Name ]:
(Z)-but-2-enedioic acid,1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine

[Synonym ]:
1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine
Piperazine,1-methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)-,maleate (1:2)
1-Methyl-4-(2,3,4,5-tetrahydro-1-benzothiepin-5-yl)piperazine maleate (1:2)

Chemical & Physical Properties

[ Molecular Formula ]:
C23H30N2O8S

[ Molecular Weight ]:
494.55800

[ Exact Mass ]:
494.17200

[ PSA ]:
180.98000

[ LogP ]:
2.16040

[ Vapour Pressure ]:
1.68E-05mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TM1823000
CAS REGISTRY NUMBER :
21699-87-6
LAST UPDATED :
198612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H22-N2-S.2C4-H4-O4
MOLECULAR WEIGHT :
494.61

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
55 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - mydriasis (pupillary dilation) Vascular - BP lowering not characterized in autonomic section
REFERENCE :
CCCCAK Collection of Czechoslovak Chemical Communications. (Academic Press Inc. Ltd., 24-28 Oval Rd., London NW1 7DX, UK) V.1- 1929- Volume(issue)/page/year: 33,4315,1968

Related Compounds