2-Phenyl-3,4-(beta-pyrrolidinoethoxy)phenyl-6-methoxybenzofuran

CAS 3333-85-5 MFCD N/A

化学结构图

3333-85-5
SMILES: COc1ccc2c(-c3ccc(OCCN4CCCC4)cc3)c(-c3ccccc3)oc2c1.Cl

化学属性

Mol. Weight450.01
Mol. FormulaC27H27NO3.ClH

别名和识别编码

Wiswesser Line NotationT56 BOJ CR& DR DO2- AT5NTJ& HO1 &GH
Chemical Name2-Phenyl-3,4-(beta-pyrrolidinoethoxy)phenyl-6- methoxybenzofuran
Synonym 1-(2-(p-(6-Methoxy-2-phenylbenzofuran-3-yl)phenoxy)ethyl)pyrrolidine 2-phenyl-3,4-(beta-pyrrolidinoethoxy)phenyl-6- methoxybenzofuran 2-phenyl-3-4-(beta pyrrolidinoethoxy)phenyl-6-methoxybenzofuran 2-phenyl-3-p-(beta-pyrrolidinoethoxy) phenyl-6-methoxybenzofuran hydrochloride PPEPMBF
CAS Number3333-85-5
InChIKeyGUTBYHIXLJELIJ-UHFFFAOYSA-N
PubChem Substance ID3036232
InChIInChI=1S/C27H27NO3.ClH/c1-29-23-13-14-24-25(19-23)31-27(21-7-3-2-4-8-21)26(24)20-9-11-22(12-10-20)30-18-17-28-15-5-6-16-28;/h2-4,7-14,19H,5-6,15-18H2,1H3;1H
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安全信息

RTECSUY1329350 
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 90 mg/kg
SEX/DURATION            : female 4 day(s) pre-mating
                          female 1-5 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - female fertility index (e.g. # females pregnant
   per # sperm positive females; # females pregnant per # females mated)
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: 14,1185,1971

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 20 mg/kg
SEX/DURATION            : female 1-5

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE                    : 12 mg/kg
SEX/DURATION            : female 3 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Maternal Effects - uterus, cervix, vagina
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: 14,1185,1971

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 20 mg/kg
SEX/DURATION            : female 5 day(s) pre-mating
TOXIC EFFECTS :
   Reproductive - Maternal Effects - uterus, cervix, vagina
REFERENCE :
   IJEBA6 Indian Journal of Experimental Biology.  (Publications & Information
   Directorate, CSIR, Hillside Rd., New Delhi 110 012, India)  V.1-    1963-
   Volume(issue)/page/year: 12,133,1974

系列性分类

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