87587-19-7

87587-19-7 structure
87587-19-7 structure

Name ethyl 4-[[1-(1-oxidopyridin-1-ium-2-yl)ethylamino]carbamothioyl]piperazine-1-carboxylate
Density 1.32g/cm3
Boiling Point 551.3ºC at 760mmHg
Molecular Formula C15H23N5O3S
Molecular Weight 353.44000
Flash Point 287.2ºC
Exact Mass 353.15200
PSA 114.39000
LogP 1.98690
Index of Refraction 1.627

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TL1485000
CHEMICAL NAME :
1-Piperazinecarboxylic acid, 4-(2-(1-(2-pyridyl)ethyl)thiocarbazoyl)-, ethyl ester, N'''-oxide
CAS REGISTRY NUMBER :
87587-19-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H23-N5-O3-S
MOLECULAR WEIGHT :
353.49

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
320 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 27,87,1984

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87587-19-7 structure

87587-19-7

Literature: Scovill, John P.; Klayman, Daniel L.; Lambros, Chris; Childs, George E.; Notsch, John D. Journal of Medicinal Chemistry, 1984 , vol. 27, # 1 p. 87 - 91

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87587-19-7 structure

87587-19-7

Literature: Scovill, John P.; Klayman, Daniel L.; Lambros, Chris; Childs, George E.; Notsch, John D. Journal of Medicinal Chemistry, 1984 , vol. 27, # 1 p. 87 - 91

~%

87587-19-7 structure

87587-19-7

Literature: Scovill, John P.; Klayman, Daniel L.; Lambros, Chris; Childs, George E.; Notsch, John D. Journal of Medicinal Chemistry, 1984 , vol. 27, # 1 p. 87 - 91