Introduction：Basic information about CAS 120-29-6|Tropine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Tropine |
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| CAS Number | 120-29-6 | Molecular Weight | 141.211 |
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| Density | 1.1±0.1 g/cm3 | Boiling Point | 233.0±0.0 °C at 760 mmHg |
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| Molecular Formula | C8H15NO | Melting Point | 50-60 °C(lit.) |
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| MSDS | USA | Flash Point | 112.5±14.5 °C |
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Names
| Name | tropine |
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| Synonym | More Synonyms |
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Tropine BiologicalActivity
| Description | Tropine is a secondary metabolite of Solanaceae plants, is an anticholinergic agent[1]. Tropine is a common intermediate in the synthesis of a variety of bioactive alkaloids, including hyoscyamine and scopolamine[2]. |
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| Related Catalog | Signaling Pathways >>Others >>OthersResearch Areas >>Neurological Disease |
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| References | [1]. Grynkiewicz G, et al. Tropane alkaloids as medicinally useful natural products and their synthetic derivatives as new drugs.Pharmacol Rep. 2008 Jul-Aug;60(4):439-63. [2]. Richter U, et al. Overexpression of tropinone reductases alters alkaloid composition in Atropa belladonna root cultures.J Exp Bot. 2005 Feb;56(412):645-52. Epub 2005 Jan 10. |
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Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
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| Boiling Point | 233.0±0.0 °C at 760 mmHg |
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| Melting Point | 50-60 °C(lit.) |
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| Molecular Formula | C8H15NO |
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| Molecular Weight | 141.211 |
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| Flash Point | 112.5±14.5 °C |
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| Exact Mass | 141.115356 |
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| PSA | 23.47000 |
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| LogP | -0.10 |
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| Vapour Pressure | 0.0±1.0 mmHg at 25°C |
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| Index of Refraction | 1.526 |
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| InChIKey | CYHOMWAPJJPNMW-DHBOJHSNSA-N |
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| SMILES | CN1C2CCC1CC(O)C2 |
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| Storage condition | 2-8°C |
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| Water Solubility | 100 g/L (20 ºC) |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- YM3875000
- CHEMICAL NAME :
- 1-alpha-H,5-alpha-H-Tropan-3-alpha-ol
- CAS REGISTRY NUMBER :
- 120-29-6
- BEILSTEIN REFERENCE NO. :
- 0080188
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C8-H15-N-O
- MOLECULAR WEIGHT :
- 141.24
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 139 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ANCPAC Annales de Chimie. (Masson et Cie, Paris, France) V.9-15, 1914-77. Volume(issue)/page/year: 7,537,1962
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >50 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ANCPAC Annales de Chimie. (Masson et Cie, Paris, France) V.9-15, 1914-77. Volume(issue)/page/year: 7,537,1962
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Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
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| Hazard Codes | Xn:Harmful; |
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| Risk Phrases | R20/22 |
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| Safety Phrases | S22-S24/25 |
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| RIDADR | 1544 |
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| WGK Germany | 3 |
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| RTECS | YM3875000 |
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| Packaging Group | III |
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| Hazard Class | 6.1(b) |
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| HS Code | 2933990090 |
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Customs
| HS Code | 2933990090 |
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| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Articles25
More Articles
| Tropine dehydrogenase: purification, some properties and an evaluation of its role in the bacterial metabolism of tropine. Biochem. J. 307 ( Pt 2) , 603-8, (1995) Tropine dehydrogenase was induced by growth of Pseudomonas AT3 on atropine, tropine or tropinone. It was NADP(+)-dependent and gave no activity with NAD+. The enzyme was very unstable but a rapid puri... | |
| The metabolism of atropine in man. J. Pharm. Pharmacol. 38(10) , 781-4, (1986) A metabolic pattern of atropine in man, based on the detection of radiolabelled products in urine by high performance liquid chromatography after administration of [3H]atropine sulphate to a normal vo... | |
| Determination of nitrogen-15 isotope fractionation in tropine: evaluation of extraction protocols for isotope ratio measurement by isotope ratio mass spectrometry. Rapid Commun. Mass Spectrom. 23(24) , 4031-7, (2009) N-Demethylation of tropine is an important step in the degradation of this compound and related metabolites. With the purpose of understanding the reaction mechanism(s) involved, it is desirable to me... | |
Synonyms
| (1R,5S)-8-Methyl-8-azabicyclo[3.2.1]octan-3-ol |
| 8-Methyl-8-azabicyclo[3.2.1]octan-3-ol |
| Tropine |
| endo-Tropanol |
| TROPAN-3ALPHA-OL |
| 3alpha-Tropanol |
| 8-Azabicyclo[3.2.1]octan-3-ol, 8-methyl- |
| EINECS 204-384-2 |
| MFCD00005551 |
| 8-Azabicyclo[3.2.1]octan-3-ol, 8-methyl-, (1R,5S)- |
| endo-8-Methyl-8-azabicyclo[3.2.1]octan-3-ol |
| tropinol |
| 3-TROPANOL |
| TROPANOL |
