2,2'-Dimesyloxy-N-methyldipropylamine picrylsulfonate

CAS 3545-54-8 MFCD N/A

化学结构图

3545-54-8
SMILES: CC(CN(C)CC(C)S(C)(=O)=O)S(C)(=O)=O.O=[N+]([O-])c1cc([N+](=O)[O-])c(S(=O)(=O)O)c([N+](=O)[O-])c1

化学属性

Mol. Weight596.61
Mol. FormulaC9H21NO6S2.C6H3N3O9S

别名和识别编码

Wiswesser Line NotationWS1&OY1&1N1&1Y1&OSW1 &WSQR BNW DNW FNW
Chemical Name2,2'-Dimesyloxy-N-methyldipropylamine picrylsulfonate
Synonym 2,2'-Dimesyloxy-N-methyldipropylamine picrylsulfonate
CAS Number3545-54-8
InChIKeyJVMRCYCINLLEGF-UHFFFAOYSA-N
PubChem Substance ID198936
InChIInChI=1S/C9H21NO4S2.C6H3N3O9S/c1-8(15(4,11)12)6-10(3)7-9(2)16(5,13)14;10-7(11)3-1-4(8(12)13)6(19(16,17)18)5(2-3)9(14)15/h8-9H,6-7H2,1-5H3;1-2H,(H,16,17,18)
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安全信息

RTECSUB8470000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Parenteral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 38 mg/kg
TOXIC EFFECTS :
   Tumorigenic - active as anti-cancer agent
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 12,954,1964

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 38 mg/kg
TOXIC EFFECTS :
   Tumorigenic - active as anti-cancer agent
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 11,1218,1963

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 37500 ug/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CPBTAL Chemical and Pharmaceutical Bulletin.  (Japan Pub. Trading Co., USA,
   1255 Howard St., San Francisco, CA 94103)  V.6-    1958-
   Volume(issue)/page/year: 11,1218,1963

系列性分类

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