3-(tert-Butylamino)acetylindole hydrochloride hydrate

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Names

[ CAS No. ]:
78907-16-1

[ Name ]:
3-(tert-Butylamino)acetylindole hydrochloride hydrate

Chemical & Physical Properties

[ Boiling Point ]:
399ºC at 760 mmHg

[ Molecular Formula ]:
C14H21ClN2O2

[ Molecular Weight ]:
284.78200

[ Flash Point ]:
195.1ºC

[ Exact Mass ]:
284.12900

[ PSA ]:
54.12000

[ LogP ]:
3.86730

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NL5300000
CHEMICAL NAME :
Indole, 3-((tert-butylamino)acetyl)-, hydrochloride, hydrate
CAS REGISTRY NUMBER :
78907-16-1
LAST UPDATED :
198609
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C14-H18-N2-O.Cl-H.H2-O
MOLECULAR WEIGHT :
284.82
WISWESSER LINE NOTATION :
T56 BMJ DV1MX1&1&1 &GH &QH

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 :
410 mg/kg
TOXIC EFFECTS :
Behavioral - wakefulness Nutritional and Gross Metabolic - body temperature increase
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,412,1981
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
275 ug/kg
TOXIC EFFECTS :
Behavioral - wakefulness Nutritional and Gross Metabolic - body temperature increase
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,412,1981
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
90 mg/kg
TOXIC EFFECTS :
Behavioral - wakefulness Nutritional and Gross Metabolic - body temperature increase
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 15,412,1981

Related Compounds

  • 1-Chloro-3-(5-(methylthio)-2-nitrophenyl)propan-2-one
  • 1-Chloro-3-(5-chloro-2-(methylthio)phenyl)propan-2-one
  • 1-Chloro-4-(3-chloropropyl)-2-(trifluoromethylthio)benzene
  • 1-Chloro-3-(5-(methylthio)-2-(trifluoromethoxy)phenyl)propan-2-one
  • 1-Chloro-3-(5-(trifluoromethyl)-2-(trifluoromethylthio)phenyl)propan-2-one
  • 1-Chloro-3-(5-ethyl-2-(methylthio)phenyl)propan-2-one
  • 1-Chloro-3-(5-(difluoromethyl)-2-mercaptophenyl)propan-2-one
  • 1-Chloro-3-(5-ethoxy-2-(trifluoromethylthio)phenyl)propan-2-one
  • 1-Chloro-3-(5-iodo-2-methoxyphenyl)propan-2-one
  • 1-Chloro-5-(3-chloropropyl)-2-(trifluoromethoxy)benzene
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