3-(alpha-(alpha,alpha,alpha-Trifluoro-p-tolyl)benzyloxy)tropane fumarate
CAS 3560-78-9 MFCD01677551
化学结构图
SMILES: CN1[C@H]2CC[C@@H]1CC(OC(c1ccccc1)c1ccc(C(F)(F)F)cc1)C2.O=C(O)/C=C/C(=O)O
化学属性
| Mol. Formula | C22H24F3NO.C4H4O4 |
|---|---|
| Mol. Weight | 491.55 |
别名和识别编码
| Chemical Name | Tropane, 3-(alpha-(alpha,alpha,alpha-trifluoro-p-tolyl)benzyloxy)-, fumarate |
|---|---|
| Wiswesser Line Notation | T56 A ANTJ A1 GOYR&R DXFFF &QV1U1VQ -T |
| Synonym | 3-(alpha-(alpha,alpha,alpha-Trifluoro-p-tolyl)benzyloxy)tropane fumarate |
| CAS Number | 3560-78-9 |
| InChIKey | QLIPSOLAKVSUQN-WLHGVMLRSA-N |
| PubChem Substance ID | 6444412 |
| InChI | InChI=1S/C22H24F3NO.C4H4O4/c1-26-18-11-12-19(26)14-20(13-18)27-21(15-5-3-2-4-6-15)16-7-9-17(10-8-16)22(23,24)25;5-3(6)1-2-4(7)8/h2-10,18-21H,11-14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+ |
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安全信息
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 30 mg/kg 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: 14,964,1964
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 500 mg/kg 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: 14,964,1964
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