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110283-66-4

110283-66-4 structure
110283-66-4 structure
  • Name: CI 966 hydrochloride
  • Chemical Name: 1-[2-[bis[4-(trifluoromethyl)phenyl]methoxy]ethyl]-3,6-dihydro-2H-pyridine-5-carboxylic acid,hydrochloride
  • CAS Number: 110283-66-4
  • Molecular Formula: C23H22ClF6NO3
  • Molecular Weight: 509.86900
  • Create Date: 2019-01-12 18:37:22
  • Modify Date: 2024-02-04 00:16:42
  • CI-966 is a potent, selective inhibitor of the GABA transporter GAT-1 with IC50 of 0.26 and 1.2 uM for human and rat GAT-1, respectively.

Name 1-[2-[bis[4-(trifluoromethyl)phenyl]methoxy]ethyl]-3,6-dihydro-2H-pyridine-5-carboxylic acid,hydrochloride
Synonyms 3-Pyridinecarboxylic acid
Nicotinimidamide
3-PYRDINECARBOXIMIDAMIDE
3-carbamidinopyridine
Nicotinamidin
3-Amidinopyridine
pyridine-3-carboximidamide
Boiling Point 514.1ºC at 760mmHg
Molecular Formula C23H22ClF6NO3
Molecular Weight 509.86900
Flash Point 264.7ºC
Exact Mass 509.11900
PSA 49.77000
LogP 6.28680
Vapour Pressure 2.16E-11mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :
US5908290
CHEMICAL NAME :
3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-(2-(bis(4-(trifluoromethyl)pheny l)methoxy) ethyl)-, hydrochloride
CAS REGISTRY NUMBER :
110283-66-4
LAST UPDATED :
199403
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C23-H21-F6-N-O3.Cl-H
MOLECULAR WEIGHT :
509.91

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
894 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Behavioral - coma Gastrointestinal - hypermotility, diarrhea
REFERENCE :
DDREDK Drug Development Research. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 28,65,1993
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
703 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold Gastrointestinal - hypermotility, diarrhea Kidney, Ureter, Bladder - other changes
REFERENCE :
DDREDK Drug Development Research. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 28,65,1993 ** OTHER MULTIPLE DOSE TOXICITY DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
14 gm/kg/4W-C
TOXIC EFFECTS :
Behavioral - food intake (animal) Endocrine - hyperglycemia Related to Chronic Data - death
REFERENCE :
DDREDK Drug Development Research. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 28,65,1993
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
420 mg/kg/4W-I
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - ataxia
REFERENCE :
DDREDK Drug Development Research. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.1- 1981- Volume(issue)/page/year: 28,65,1993
Hazard Codes Xi