102043-42-5

102043-42-5 structure

102043-42-5 structure

Name: (5α,8β)-3-Methoxy-17-methyl-6,7-didehydro-4,5-epoxymorphinan-8-ol hydrochloride (1:1)
Chemical Name: (5α,8β)-3-Methoxy-17-methyl-6,7-didehydro-4,5-epoxymorphinan-8-ol hydrochloride (1:1)
CAS Number: 102043-42-5
Molecular Formula: C₁₈H₂₂ClNO₃
Molecular Weight: 335.82500
Create Date: 2016-10-14 01:58:33
Modify Date: 2024-09-12 11:59:11

Name	(5α,8β)-3-Methoxy-17-methyl-6,7-didehydro-4,5-epoxymorphinan-8-ol hydrochloride (1:1)
Synonyms	PGE2 1,15-lactone (1R,2R,3S,5R)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol (1R,2R,3S,4R)-2,6,6-trimethylcyclo[3.1.1]heptane-2,3-diol (-)-podorhizol (-)epi-podorhizol (-)-pinane-2,3-diol (-)-prostaglandin E2-1,15-lactone Pinanediol [INCI] (-)-2,3-Pinanediol (1R,2R,3S,5R)-(-)-Pinanediol (1R,2R,3S,5R)-(-)-2,3-Pinanediol (-)-cis-Pinane-cis-2,3-diol (3S,11aR,14R,14aR)-14-hydroxy-3-pentyl-6,7,8,11,11a,13,14,14a-octahydro-3H-cyclopenta[e]oxacyclotridecine-5,12-dione (1R,2R,3S,5R)-2,6,6-trimethylbicyclo[3.3.1]heptane-2,3-diol (-)-(1R,2R,3S,5R)-pinane-2,3-diol (-)-pinanediol (-)-pseudocodeine,hydrochloride [1R-(1\|A,2\|A,3\|A,5\|A)]-2,6,6-Trimethylbicyclo[3.1.1]heptane-2,3-diol (-)-Pseudocodein,Hydrochlorid (-)-2-Hydroxyisopinocampheol

Boiling Point	466ºC at 760mmHg
Molecular Formula	C₁₈H₂₂ClNO₃
Molecular Weight	335.82500
Flash Point	235.7ºC
Exact Mass	335.12900
PSA	41.93000
LogP	2.24100
Vapour Pressure	1.74E-09mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: QD1055000

CHEMICAL NAME :: Morphinan-8-beta-ol, 6,7-didehydro-4,5-alpha-epoxy-3-methoxy-17-methyl-, hydrochloride

CAS REGISTRY NUMBER :: 102043-42-5

LAST UPDATED :: 199009

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C18-H21-N-O3.Cl-H

MOLECULAR WEIGHT :: 335.86

WISWESSER LINE NOTATION :: T B6566 B6/CO 4ABBC R BX HO PN EU GHT&&TTJ DQ JO1 P1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2 gm/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - muscle weakness

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 51,35,1934

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 579 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 66,182,1939

467-08-3 structure

467-08-3

~25%

102043-42-5 structure

102043-42-5

Literature: Journal of Organic Chemistry, , vol. 63, # 5 p. 1704 - 1705