[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate

Modify Date: 2024-04-05 14:19:57

[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate Structure
[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate structure
 Common Name [(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate
CAS Number 981-01-1 Molecular Weight 369.41100
Density 1.35g/cm3 Boiling Point 514.5ºC at 760 mmHg
Molecular Formula C21H23NO5 Melting Point N/A
MSDS N/A Flash Point 265ºC

 Names

Name [(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.35g/cm3
Boiling Point 514.5ºC at 760 mmHg
Molecular Formula C21H23NO5
Molecular Weight 369.41100
Flash Point 265ºC
Exact Mass 369.15800
PSA 65.07000
LogP 1.72300
Index of Refraction 1.631

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QD2167000
CHEMICAL NAME :
Morphinan-6-one, 7,8-didehydro-4,5-alpha-epoxy-14-hydroxy-3-methoxy-17 -methyl-, propionate (ester)
CAS REGISTRY NUMBER :
981-01-1
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C21-H23-N-O5
MOLECULAR WEIGHT :
369.45

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
150 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 16(Suppl),68T,1964
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
110 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
JPPMAB Journal of Pharmacy and Pharmacology. (Pharmaceutical Soc. of Great Britain, 1 Lambeth High St., London SEI 7JN, UK) V.1- 1949- Volume(issue)/page/year: 16(Suppl),68T,1964

 Synthetic Route

(4R,4aS,7S,7aR,12bS)-9-methoxy-3-methyl-1,2,4,7,7a,13-hexahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-4a,7-diol structure

(4R,4aS,7S,7aR,...

CAS#:4829-46-3

~%

[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate Structure

[(4R,4aS,7aR,12...

CAS#:981-01-1

Literature: Currie,A.C. et al. Journal of the Chemical Society, 1960 , p. 773 - 781
14-hydroxycodeine diacatate structure

14-hydroxycodei...

CAS#:103458-67-9

~%

[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate Structure

[(4R,4aS,7aR,12...

CAS#:981-01-1

Literature: Currie,A.C. et al. Journal of the Chemical Society, 1960 , p. 773 - 781
6α-acetoxy-4,5α-epoxy-3-methoxy-17-methyl-morphin-7-en-14-ol structure

6α-acetoxy-4,5α...

CAS#:100740-63-4

~%

[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate Structure

[(4R,4aS,7aR,12...

CAS#:981-01-1

Literature: Currie,A.C. et al. Journal of the Chemical Society, 1960 , p. 773 - 781
14-Hydroxy Codeinone structure

14-Hydroxy Codeinone

CAS#:508-54-3

Propionic anhydride structure

Propionic anhydride

CAS#:123-62-6

~%

[(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate Structure

[(4R,4aS,7aR,12...

CAS#:981-01-1

Literature: Currie,A.C. et al. Journal of the Chemical Society, 1960 , p. 773 - 781

 Synonyms

14-Propionyloxy-kodeinon
14-Propionyloxycodeinon
Codeinone,14-hydroxy-,propionate
Morphinan-6-one,7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-(1-oxopropoxy)-,(5alpha)
Morphinan-6-one,7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-14-(1-oxopropoxy)-,(5)
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Chemsrc provides CAS#:981-01-1 MSDS, density, melting point, boiling point, structure, etc. Its name is [(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate>> amp version: [(4R,4aS,7aR,12bS)-9-methoxy-3-methyl-7-oxo-2,4,7a,13-tetrahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-4a-yl] propanoate

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