110579-05-0

110579-05-0 structure
110579-05-0 structure

Name 2-(3-benzyl-2-methyl-5-nitroimidazol-4-yl)sulfanyl-N,N-diethylethanamine
Synonyms Ethanamine,N,N-diethyl-2-((2-methyl-4-nitro-1-(phenylmethyl)-1H-imidazol-5-yl)thio)
1H-Imidazole,5-((2-(diethylamino)ethyl)thio)-2-methyl-4-nitro-1-(phenylmethyl)
1-(Phenylmethyl)-5-((2-(diethylamino)ethyl)thio)-2-methyl-4-nitro-1H-imidazole
Density 1.19g/cm3
Boiling Point 495.1ºC at 760 mmHg
Molecular Formula C17H24N4O2S
Molecular Weight 348.46300
Flash Point 253.2ºC
Exact Mass 348.16200
PSA 92.18000
LogP 4.10510
Vapour Pressure 6.1E-10mmHg at 25°C
Index of Refraction 1.596

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NI4802400
CHEMICAL NAME :
1H-Imidazole, 5-((2-(diethylamino)ethyl)thio)-2-methyl-4-nitro-1-(p henylmethyl)-
CAS REGISTRY NUMBER :
110579-05-0
LAST UPDATED :
199709
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H24-N4-O2-S
MOLECULAR WEIGHT :
348.51

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
200 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
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: 21,403,1987

~65%

110579-05-0 structure

110579-05-0

Literature: Iradyan, M. A.; Ayvazyan, A. Kh.; Mirzoyan, V. S.; Paronikyan, G. M.; Sarkisyan, T. P.; et al. Pharmaceutical Chemistry Journal, 1987 , vol. 21, # 6 p. 403 - 408 Khimiko-Farmatsevticheskii Zhurnal, 1987 , vol. 21, # 6 p. 667 - 672
Precursor  1

DownStream  0