Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: dioscoretine
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
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Contact: Ms Wang

128637-87-6

128637-87-6 structure

128637-87-6 structure

Name: dioscoretine
Chemical Name: (3S)-4-[(1R,4R)-5-hydroxy-2-methyl-2-azabicyclo[2.2.2]octan-5-yl]-3-methylbutanoic acid
CAS Number: 128637-87-6
Molecular Formula: C₁₃H₂₃NO₃
Molecular Weight: 241.32700
Create Date: 2017-05-04 05:57:03
Modify Date: 2024-03-09 16:53:05

Name	(3S)-4-[(1R,4R)-5-hydroxy-2-methyl-2-azabicyclo[2.2.2]octan-5-yl]-3-methylbutanoic acid
Synonyms	Dioscoretine Dioscoretin

Density	1.14g/cm3
Boiling Point	409.2ºC at 760mmHg
Molecular Formula	C₁₃H₂₃NO₃
Molecular Weight	241.32700
Flash Point	201.3ºC
Exact Mass	241.16800
PSA	60.77000
LogP	1.27040
Vapour Pressure	2.11E-08mmHg at 25°C
Index of Refraction	1.525

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CL5602600

CHEMICAL NAME :: 2-Azabicyclo(2.2.2)octane-5-butanoic acid, beta,2-dimethyl-5-hydroxy-, (1R-(1-alpha,4-alpha,5-alpha,5(S*)))-

CAS REGISTRY NUMBER :: 128637-87-6

LAST UPDATED :: 199409

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C13-H23-N-O3

MOLECULAR WEIGHT :: 241.37

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 :: 580 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: PLMEAA Planta Medica. (Georg Thieme Verlag, Postfach 732, D-7000 Stuttgart 1, Fed. Rep. Ger.) V.1- 1953- Volume(issue)/page/year: 56,264,1990