3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium,chloride
Names
[ CAS No. ]:
26106-21-8
[ Name ]:
3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium,chloride
[Synonym ]:
LU 5-046 hydrochloride
3-(1-methoxycarbonyl-3,3-dimethyl-2-benzothiophen-1-yl)propyl-dimethylazanium chloride
Benzo(c)thiophene-1-carboxylic acid,1,3-dihydro-3,3-dimethyl-1-(3-(dimethylamino)propyl)-,methyl ester,hydrochloride
Chemical & Physical Properties
[ Boiling Point ]:
392.1ºC at 760mmHg
[ Molecular Formula ]:
C17H26ClNO2S
[ Molecular Weight ]:
343.91200
[ Flash Point ]:
190.9ºC
[ Exact Mass ]:
343.13700
[ PSA ]:
54.84000
[ LogP ]:
4.18060
[ Vapour Pressure ]:
2.35E-06mmHg at 25°C
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DL9602000
- CHEMICAL NAME :
- Benzo(c)thiophene-1-carboxylic acid, 1,3-dihydro-3,3-dimethyl-1-(3-(dimethylamino)propyl)- , methyl ester, hydrochloride
- CAS REGISTRY NUMBER :
- 26106-21-8
- LAST UPDATED :
- 198506
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C17-H25-N-O2-S.Cl-H
- MOLECULAR WEIGHT :
- 343.95
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 50 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- APTOA6 Acta Pharmacologica et Toxicologica. (Copenhagen, Denmark) V.1-59, 1945-86. For publisher information, see PHTOEH Volume(issue)/page/year: 28,241,1970
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 23 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- APTOA6 Acta Pharmacologica et Toxicologica. (Copenhagen, Denmark) V.1-59, 1945-86. For publisher information, see PHTOEH Volume(issue)/page/year: 28,241,1970