1,4-Cyclohexanebis(methylamine), N,N'-bis(4-dimethylaminobenzyl)-, tetrahydrochloride

CAS 1254-80-4 MFCD N/A

化学结构图

1254-80-4
SMILES: CN(C)c1ccc(CNCC2CCC(CNCc3ccc(N(C)C)cc3)CC2)cc1.Cl.Cl.Cl.Cl

化学属性

Mol. Weight554.54
Mol. FormulaC26H40N4.4ClH

别名和识别编码

Wiswesser Line NotationL6TJ A1M1R DN1&1& D1M1R DN1&1 &GH 4
Chemical Name1,4-Cyclohexanebis(methylamine), N,N'-bis(4-dimethylaminobenzyl)-, tetrahydrochloride
Synonym Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(4-dimethylamino-,
CAS Number1254-80-4
InChIKeyQXMJKFZFEVGIQU-UHFFFAOYSA-N
PubChem Substance ID102061
InChIInChI=1S/C26H40N4.4ClH/c1-29(2)25-13-9-23(10-14-25)19-27-17-21-5-7-22(8-6-21)18-28-20-24-11-15-26(16-12-24)30(3)4;;;;/h9-16,21-22,27-28H,5-8,17-20H2,1-4H3;4*1H
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安全信息

RTECSGU7061000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 162 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: 9,329,1966

系列性分类

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