Acetic acid, 2-benzyloxy-2,2-diphenyl-, (1-methyl-2-pyrrolidinyl)methyl ester, hydrochloride

CAS 3212-45-1 MFCD N/A

化学结构图

3212-45-1
SMILES: C[NH+]1CCCC1COC(=O)C(OCc1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]

化学属性

Mol. Weight452.03
Mol. FormulaC27H29NO3.ClH

别名和识别编码

Wiswesser Line NotationT5NTJ A1 B1OVXR&R&O1R &GH
Chemical NameAcetic acid, 2-benzyloxy-2,2-diphenyl-, (1-methyl-2-pyrrolidinyl)methyl ester, hydrochloride
Synonym 2-Benzyloxy-2,2-diphenylacetic acid (1-methyl-2-pyrrolidinyl)methyl ester
CAS Number3212-45-1
InChIKeyKHZOVTCGYKJECR-UHFFFAOYSA-N
PubChem Substance ID18567
InChIInChI=1S/C27H29NO3.ClH/c1-28-19-11-18-25(28)21-30-26(29)27(23-14-7-3-8-15-23,24-16-9-4-10-17-24)31-20-22-12-5-2-6-13-22;/h2-10,12-17,25H,11,18-21H2,1H3;1H
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安全信息

RTECSAF5100000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 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: 8,571,1965

系列性分类

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