3-(m-Acetoxyphenyl)-3-butyl-1-methylpyrrolidine

CAS 1989-57-7 MFCD N/A

化学结构图

1989-57-7
SMILES: CCCCC1(c2cccc(OC(C)=O)c2)CCN(C)C1

化学属性

Mol. FormulaC17H25NO2
Mol. Weight275.43

别名和识别编码

Synonym 3-(m-Acetoxyphenyl)-3-butyl-1-methylpyrrolidine m-(3-Butyl-1-methyl-3-pyrrolidinyl)phenol acetate
Wiswesser Line NotationT5NTJ A1 C4 CR COV1
Chemical NamePhenol, m-(3-butyl-1-methyl-3-pyrrolidinyl)-, acetate
CAS Number1989-57-7
Beilstein Registry Number1385617
InChIKeySHFPXYHIJJLNLS-UHFFFAOYSA-N
PubChem Substance ID121575
InChIInChI=1S/C17H25NO2/c1-4-5-9-17(10-11-18(3)13-17)15-7-6-8-16(12-15)20-14(2)19/h6-8,12H,4-5,9-11,13H2,1-3H3
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安全信息

RTECSSK1730000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 86 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: 8,316,1965

系列性分类

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