N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-hydroxy-3-methylbut-1-ynyl)benzamide
Names
[ CAS No. ]:
5853-05-4
[ Name ]:
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-hydroxy-3-methylbut-1-ynyl)benzamide
[Synonym ]:
n-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-hydroxy-3-methyl-but-1-ynyl)benzamide
Chemical & Physical Properties
[ Molecular Formula ]:
C22H25NO4
[ Molecular Weight ]:
367.43800
[ Exact Mass ]:
367.17800
[ PSA ]:
67.79000
[ LogP ]:
3.18960
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- HA4900000
- CHEMICAL NAME :
- Cytisinium, N,N-dimethyl-, iodide
- CAS REGISTRY NUMBER :
- 5853-05-4
- LAST UPDATED :
- 199112
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C13-H19-N2-O.I
- MOLECULAR WEIGHT :
- 346.24
- WISWESSER LINE NOTATION :
- T C666 A GVN LK&TTJ L1 L1 &Q &I
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 :
- >2770 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - muscle contraction or spasticity
- REFERENCE :
- BJPCBM British Journal of Pharmacology. (Macmillan Press Ltd., Houndmills, Basingstoke, Hants. RG21 2XS, UK) V.34- 1968- Volume(issue)/page/year: 35,161,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- >692 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - muscle contraction or spasticity
- REFERENCE :
- BJPCBM British Journal of Pharmacology. (Macmillan Press Ltd., Houndmills, Basingstoke, Hants. RG21 2XS, UK) V.34- 1968- Volume(issue)/page/year: 35,161,1969
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 61 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Behavioral - rigidity (including catalepsy)
- REFERENCE :
- BJPCBM British Journal of Pharmacology. (Macmillan Press Ltd., Houndmills, Basingstoke, Hants. RG21 2XS, UK) V.34- 1968- Volume(issue)/page/year: 35,161,1969