4-(2-((3-Amino-4-pyridyl)amino)ethyl)catechol

CAS 451-75-2 MFCD00451752

化学结构图

451-75-2
SMILES: Nc1cnccc1NCCc1ccc(O)c(O)c1

化学属性

Mol. FormulaC13H15N3O2
Mol. Weight245.31

别名和识别编码

Chemical Nameo-Catechol, 4-(2-((3-amino-4-pyridyl)amino)ethyl)-
Chemicalbook IDCB02379223
Synonym 4-(2-((3-Amino-4-pyridyl)amino)ethyl)catechol Pyridine, 3-amino-4-(3,4-dihydroxyphenethylamino)-
Wiswesser Line NotationT6NJ CZ DM2R CQ DQ
CAS Number451-75-2
Beilstein Registry Number0483178
InChIKeyKEQDYXZIMWLSER-UHFFFAOYSA-N
PubChem Substance ID9954
InChIInChI=1S/C13H15N3O2/c14-13-8-10(4-6-16-13)15-5-3-9-1-2-11(17)12(18)7-9/h1-2,4,6-8,17-18H,3,5H2,(H3,14,15,16)
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安全信息

RTECSFI4950000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 150 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: 8,296,1965

系列性分类

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