Carbanilic acid, p-(bis(2-chloroethyl)amino)-, isopropyl ester

CAS 2045-44-5 MFCD N/A

化学结构图

2045-44-5
SMILES: CC(C)OC(=O)Nc1ccc(N(CCCl)CCCl)cc1

化学属性

Mol. Weight319.26
Mol. FormulaC14H20Cl2N2O2

别名和识别编码

Chemical NameCarbanilic acid, p-(bis(2-chloroethyl)amino)-, isopropyl ester
Chemicalbook IDCB72354670
Synonym Isopropyl p-(bis(2-chloroethyl)amino)carbanilate
Wiswesser Line NotationG2N2GR DMVOY1&1
Beilstein Registry Number2817008
CAS Number2045-44-5
InChIKeyIJMUVZABOPSWCH-UHFFFAOYSA-N
PubChem Substance ID16287
InChIInChI=1S/C14H20Cl2N2O2/c1-11(2)20-14(19)17-12-3-5-13(6-4-12)18(9-7-15)10-8-16/h3-6,11H,7-10H2,1-2H3,(H,17,19)
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安全信息

RTECSFD7500000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 171 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: 8,167,1965

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 520 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: 8,167,1965

系列性分类

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