Butyrophenone, 4'-fluoro-4-(9-methyl-3,9-diazaspiro(5.5)undec-3-yl)-, dihydrochloride
CAS 1164-74-5 MFCD N/A
化学结构图
SMILES: C[NH+]1CCC2(CC1)CC[NH+](CCCC(=O)c1ccc(F)cc1)CC2.[Cl-].[Cl-]
化学属性
| Mol. Weight | 405.43 |
|---|---|
| Mol. Formula | C20H29FN2O.2ClH |
别名和识别编码
| Wiswesser Line Notation | T6N DXTJ A3VR DF& D-& DT6N DXTJ A1 &GH 2 |
|---|---|
| Chemical Name | Butyrophenone, 4'-fluoro-4-(9-methyl-3,9-diazaspiro(5.5)undec-3-yl)-, dihydrochloride |
| Synonym | 4'-Fluoro-4-(9-methyl-3,9-diazaspiro(5.5)undec-3-yl)butyrophenone |
| CAS Number | 1164-74-5 |
| InChIKey | MHPSVUBTALLMNU-UHFFFAOYSA-N |
| PubChem Substance ID | 14417 |
| InChI | InChI=1S/C20H29FN2O.2ClH/c1-22-13-8-20(9-14-22)10-15-23(16-11-20)12-2-3-19(24)17-4-6-18(21)7-5-17;;/h4-7H,2-3,8-16H2,1H3;2*1H |
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安全信息
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 100 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 8,62,1965
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