3-(p-(Bis(2-chloroethyl)amino)benzylsulfonyl)-L-alanine

CAS 6940-98-3 MFCD06940983

化学结构图

6940-98-3
SMILES: N[C@@H](CS(=O)(=O)Cc1ccc(N(CCCl)CCCl)cc1)C(=O)O

化学属性

Mol. Weight383.32
Mol. FormulaC14H20Cl2N2O4S

别名和识别编码

Chemical NameAlanine, beta-(p-(bis(2-chloroethyl)amino)benzylsulfonyl)-, L-
Chemicalbook IDCB82232209
Synonym 3-p-Bis(2-chloroethyl)amino benzylsulfonyl-L-alanine
Wiswesser Line NotationQVYZ1SW1R DN2G2G -L
Beilstein Registry Number2821420
CAS Number6940-98-3
InChIKeyYDMMNUBREJUGOU-UHFFFAOYSA-N
PubChem Substance ID23373
InChIInChI=1S/C14H20Cl2N2O4S/c15-5-7-18(8-6-16)12-3-1-11(2-4-12)9-23(21,22)10-13(17)14(19)20/h1-4,13H,5-10,17H2,(H,19,20)
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安全信息

RTECSAY3278000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 5600 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#00684

系列性分类

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