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82058-30-8

82058-30-8 structure
82058-30-8 structure

Name N-butyl-5-methyl-9-oxo-2,4,6,8-tetraphenyl-3,7-diazabicyclo[3.3.1]nonane-3-carboxamide
Synonyms ita 433
Density 1.149g/cm3
Boiling Point 721.1ºC at 760 mmHg
Molecular Formula C37H39N3O2
Molecular Weight 557.72400
Flash Point 389.9ºC
Exact Mass 557.30400
PSA 61.44000
LogP 8.22930
Index of Refraction 1.601

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HM0341000
CHEMICAL NAME :
3,7-Diazabicyclo(3.3.1)nonane-3-carboxamide, N-butyl-5-methyl-9-oxo-2,4,6,8-tetraphenyl-
CAS REGISTRY NUMBER :
82058-30-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C37-H39-N3-O2
MOLECULAR WEIGHT :
557.79
WISWESSER LINE NOTATION :
T66 A AV DM INTJ B1 CR& ER& GR& HVM4 IR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
3 gm/kg
TOXIC EFFECTS :
Autonomic Nervous System - smooth muscle relaxant (mechanism undefined, spasmolytic) Behavioral - muscle weakness Behavioral - antianxiety
REFERENCE :
EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 17,187,1982

~27%

82058-30-8 structure

82058-30-8

Literature: Ribalta; Ribas; Martinez Tobed; et al. European Journal of Medicinal Chemistry, 1982 , vol. 17, # 2 p. 187 - 190