| Chemical & Physical Properties | |
|---|---|
| CAS Number | 827-61-2 |
| Catalog No. | 2A-9009031 |
| Chinese Name | 乙酰克里定 |
| Synonyms | 3-Acetoxyquinuclidine; Quinuclidin-3-yl acetate; aceclidine; Glaucostat |
| Molecular Formula | C9H15O2N1 |
| Molecular Weight | 169.22 |
| Purity | 98.00 |
| Boiling Point | 221.5ºC at 760 mmHg |
| Storage Condition | Warehouse Ventilation Low Temperature Drying |
| Application | Acetylcholine is a modulator of the M3 muscarinic acetylcholine receptor. Aceclidine is a cycloplegic agent, surfactant, tonicity adjuster and optional viscosifier and antioxidant. Aceclidine has the |
| HTC | 2933990090 |
| MDL Number | MFCD00468105 |
| SMILES | CC(=O)OC1CN2CCC1CC2 |
| InChI | InChI=1S/C9H15NO2/c1-7(11)12-9-6-10-4-2-8(9)3-5-10/h8-9H,2-6H2,1H3 |
| InChI Key | WRJPSSPFHGNBMG-UHFFFAOYSA-N |
| MSDS | msds/9031_1_827_61_2.pdf |
| Use of | Properties Name 1-azabicyclo[2.2.2]octan-3-yl acetate Synonym More Synonyms Aceclidine Biological Activity Related Catalog Signaling Pathways >> Neuronal Signaling >> mAChR Signaling Pathways >> GPCR/G Protein >> mAChR Research Areas >> Neurological Disease References [1]. Gerald Horn, et al. Storage Stable Compositions and Methods for the Treatment of Refractive Errors of the Eye. Patent US20150290125A1. [2]. Thomas G. Gant, et al. Imidazole modulators of muscarinic acetylcholine receptor m3. Patent US20110091459A1. Chemical & Physical Properties Molecular Formula C9H15NO2 Exact Mass 169.11000 PSA 29.54000 LogP 0.58160 InChIKey WRJPSSPFHGNBMG-UHFFFAOYSA-N Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 3-Quinuclidinol, acetate (ester) CAS REGISTRY NUMBER : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C9-H15-N-O2 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : T66 A B CNTJ AOV1 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,320,1968 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,320,1968 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,320,1968 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Behavioral - tremor Behavioral - analgesia Nutritional and Gross Metabolic - body temperature decrease REFERENCE : AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 189,295,1971 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : REFERENCE : ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 18,320,1968 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : REFERENCE : RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 35,55,1972 Safety Information Hazard Codes Xi HS Code 2933990090 Synthetic Route Ethanoic anhydride CAS#:108-24-7 3-Quinuclidinol CAS#:1619-34-7 Aceclidine CAS#:827-61-2 Literature: Langlois; Meyer; Soulier Synthetic Communications, 1992 , vol. 22, # 13 p. 1895 - 1911 3-Quinuclidinol CAS#:1619-34-7 Aceclidine CAS#:827-61-2 Literature: Bracco International B.V. Patent: US5387409 A1, 1995 ; 3-Quinuclidinon... CAS#:1193-65-3 Aceclidine CAS#:827-61-2 Literature: Helvetica Chimica Acta, , vol. 40, p. 2170,2176 Precursor & DownStream Precursor 4 CAS#:108-24-7 Ethanoic anhydride CAS#:1619-34-7 3-Quinuclidinol CAS#:1193-65-3 3-Quinuclidinon... CAS#:76656-18-3 3-acetoxy-1-((m... DownStream 2 CAS#:25333-42-0 (R)-(-)-3-Quinu... CAS#:41967-35-5 1-Azoniabicyclo... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: 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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