CAS 6106-46-3|Scopolamine Methyl Nitrate

Introduction:Basic information about CAS 6106-46-3|Scopolamine Methyl Nitrate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameScopolamine Methyl Nitrate
CAS Number6106-46-3Molecular Weight380.392
Density1.31 g/cm3Boiling Point460.3ºC at 760 mmHg
Molecular FormulaC18H24N2O7Melting Point199ºC
MSDS/Flash Point232.2ºC

Names

NameScopolamine Methyl Nitrate
SynonymMore Synonyms

Scopolamine Methyl Nitrate BiologicalActivity

DescriptionScopolamine Methyl Nitrate is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related CatalogResearch Areas >>Others

Chemical & Physical Properties

Density1.31 g/cm3
Boiling Point460.3ºC at 760 mmHg
Melting Point199ºC
Molecular FormulaC18H24N2O7
Molecular Weight380.392
Flash Point232.2ºC
Exact Mass380.158356
PSA127.94000
LogP1.30560
Index of Refraction-25 ° (C=1, H2O)
InChIKeyBSQIVYOSLFLSGE-UHFFFAOYSA-N
SMILESC[N+]1(C)C2CC(OC(=O)C(CO)c3ccccc3)CC1C1OC12.O=[N+]([O-])[O-]

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
YM3675150
CHEMICAL NAME :
1-alpha-H,5-alpha-H-Tropanium, 6-beta,7-beta-epoxy-3-alpha-hydroxy-8-methyl-, nitrate, (-)- tropate
CAS REGISTRY NUMBER :
6106-46-3
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C18-H24-N-O4.N-O3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1864 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
TXAPA9 Toxicology and Applied Pharmacology. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1959- Volume(issue)/page/year: 1,42,1959
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
126 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CLDND* Compilation of LD50 Values of New Drugs. (J.R. MacDougal, Dept. of National Health and Welfare, Food and Drug Divisions, 35 John St., Ottawa, Ont., Canada) *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 80513 No. of Facilities: 68 (estimated) No. of Industries: 1 No. of Occupations: 6 No. of Employees: 2770 (estimated)

Safety Information

Hazard CodesT: Toxic;
Risk PhrasesR23/24/25
Safety Phrases36/37/39-45-25
RIDADRUN 1544 6.1/PG 3
WGK Germany3
RTECSYM3675150

Synonyms

scopolamine methyl nitrate
(1R,2R,4S,5S,7s)-7-{[(2S)-3-Hydroxy-2-phenylpropanoyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.0]nonane nitrate
MFCD00078239
EINECS 228-065-2
CAS 71750-39-5|2-PHENYLETHYLAMINE SULFATE
CAS 304655-91-2|POTASSIUM TARTRATE
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