alpha-(2-(Ethylphenethylamino)-1-methylethyl)benzhydrol oxalate

CAS 4119-01-1 MFCD N/A

化学结构图

4119-01-1
SMILES: CCN(CCc1ccccc1)CC(C)C(O)(c1ccccc1)c1ccccc1.O=C(O)C(=O)O

化学属性

Mol. Weight463.62
Mol. FormulaC26H31NO.C2H2O4

别名和识别编码

Wiswesser Line NotationQXR&R&Y1&1N2&2R &QVVQ
Chemical NameBenzhydrol, alpha-(2-(ethylphenethylamino)-1-methylethyl)-, oxalate (1:1)
Synonym 1-Propanol, 1,1-diphenyl-3-ethylphenethylamino-2-methyl-, oxalate alpha-(2-(Ethylphenethylamino)-1-methylethyl)benzhydrol oxalate
CAS Number4119-01-1
InChIKeyLNCPOQUOOGYXTR-UHFFFAOYSA-N
PubChem Substance ID199392
InChIInChI=1S/C26H31NO.C2H2O4/c1-3-27(20-19-23-13-7-4-8-14-23)21-22(2)26(28,24-15-9-5-10-16-24)25-17-11-6-12-18-25;3-1(4)2(5)6/h4-18,22,28H,3,19-21H2,1-2H3;(H,3,4)(H,5,6)
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安全信息

RTECSDC8523600 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 1500 mg/kg
TOXIC EFFECTS :
   Behavioral - anticonvulsant
   Kidney, Ureter, Bladder - urine volume increased
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: 8,836,1965

系列性分类

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