10b,10c-Ethano-1,4-methano-4H,9H-oxepino[3,4,5-ij]oxireno[b]quinolizin-2(1H)-one,hexahydro-12-methyl-, (1S,4R,4aS,9aR,10aS,10bS,10cS,12R)- (9CI)

Modify Date: 2024-02-15 09:42:38

10b,10c-Ethano-1,4-methano-4H,9H-oxepino[3,4,5-ij]oxireno[b]quinolizin-2(1H)-one,hexahydro-12-methyl-, (1S,4R,4aS,9aR,10aS,10bS,10cS,12R)- (9CI) Structure
10b,10c-Ethano-1,4-methano-4H,9H-oxepino[3,4,5-ij]oxireno[b]quinolizin-2(1H)-one,hexahydro-12-methyl-, (1S,4R,4aS,9aR,10aS,10bS,10cS,12R)- (9CI) structure
Common Name 10b,10c-Ethano-1,4-methano-4H,9H-oxepino[3,4,5-ij]oxireno[b]quinolizin-2(1H)-one,hexahydro-12-methyl-, (1S,4R,4aS,9aR,10aS,10bS,10cS,12R)- (9CI)
CAS Number 559-49-9 Molecular Weight 275.34300
Density 1.37g/cm3 Boiling Point 462ºC at 760mmHg
Molecular Formula C16H21NO3 Melting Point N/A
MSDS N/A Flash Point 233.2ºC

 Names

Name (3S,4R,6S,9R,10S,16R,17S)-12-methyl3,12-dioxa-6-azahexacyclo[8.4.3.111,14.01,17.02,4.06,17]octadecane-7-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.37g/cm3
Boiling Point 462ºC at 760mmHg
Molecular Formula C16H21NO3
Molecular Weight 275.34300
Flash Point 233.2ºC
Exact Mass 275.15200
PSA 42.07000
LogP 1.12760
Index of Refraction 1.631

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CA1190000
CHEMICAL NAME :
Annotinine
CAS REGISTRY NUMBER :
559-49-9
BEILSTEIN REFERENCE NO. :
0030714
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H21-N-O3
MOLECULAR WEIGHT :
275.38

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
115 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 34,197,1945

 Synonyms

Annotinin
ANNOTININE