hydrogen carbonate,methyl-[3-(5-methylsulfanyl-1H-indol-3-yl)butan-2-yl]azanium
Names
[ CAS No. ]:
5490-56-2
[ Name ]:
hydrogen carbonate,methyl-[3-(5-methylsulfanyl-1H-indol-3-yl)butan-2-yl]azanium
[Synonym ]:
INDOLE,3-(3-METHYLAMINO-2-BUTYL)-5-METHYLTHIO-,BICARBONATE
3-(2'-Methylaminobutyl-3')-5-methylthioindole bicarbonate
HYDROXYFORMATE
N-methyl-3-[5-(methylsulfanyl)-1H-indol-3-yl]butan-2-aminium hydrogen carbonate
methyl-[3-(5-methylsulfanyl-1H-indol-3-yl)butan-2-yl]azanium
Chemical & Physical Properties
[ Boiling Point ]:
408.4ºC at 760 mmHg
[ Molecular Formula ]:
C15H22N2O3S
[ Molecular Weight ]:
310.41200
[ Flash Point ]:
200.8ºC
[ Exact Mass ]:
310.13500
[ PSA ]:
110.65000
[ LogP ]:
4.21450
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- NM0400000
- CHEMICAL NAME :
- Indole, 3-(3-methylamino-2-butyl)-5-methylthio-, bicarbonate
- CAS REGISTRY NUMBER :
- 5490-56-2
- LAST UPDATED :
- 199012
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C14-H20-N2-S.C-H2-O3
- MOLECULAR WEIGHT :
- 310.45
- WISWESSER LINE NOTATION :
- T56 BMJ DY1&Y1&M1 GS1 &..H2.C-O3
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 :
- 79 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#12436