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 Name | Scopolamine Methyl Nitrate |
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| CAS Number | 6106-46-3 | Molecular Weight | 380.392 |
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| Density | 1.31 g/cm3 | Boiling Point | 460.3ºC at 760 mmHg |
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| Molecular Formula | C18H24N2O7 | Melting Point | 199ºC |
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| MSDS | / | Flash Point | 232.2ºC |
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Names
| Name | Scopolamine Methyl Nitrate |
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| Synonym | More Synonyms |
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Scopolamine Methyl Nitrate BiologicalActivity
| Description | Scopolamine Methyl Nitrate is a biochemical reagent that can be used as a biological material or organic compound for life science related research. |
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| Related Catalog | Research Areas >>Others |
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Chemical & Physical Properties
| Density | 1.31 g/cm3 |
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| Boiling Point | 460.3ºC at 760 mmHg |
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| Melting Point | 199ºC |
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| Molecular Formula | C18H24N2O7 |
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| Molecular Weight | 380.392 |
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| Flash Point | 232.2ºC |
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| Exact Mass | 380.158356 |
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| PSA | 127.94000 |
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| LogP | 1.30560 |
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| Index of Refraction | -25 ° (C=1, H2O) |
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| InChIKey | BSQIVYOSLFLSGE-UHFFFAOYSA-N |
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| SMILES | C[N+]1(C)C2CC(OC(=O)C(CO)c3ccccc3)CC1C1OC12.O=[N+]([O-])[O-] |
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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 DATAACUTE 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)
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Safety Information
| Hazard Codes | T: Toxic; |
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| Risk Phrases | R23/24/25 |
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| Safety Phrases | 36/37/39-45-25 |
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| RIDADR | UN 1544 6.1/PG 3 |
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| WGK Germany | 3 |
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| RTECS | YM3675150 |
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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 |