3,3-Dimethyl-4-(dimethylamino)-4-(m-tolyl)butyl m-tolyl ketone

CAS 3215-88-1 MFCD03215881

化学结构图

3215-88-1
SMILES: Cc1cccc(C(=O)CCC(C)(C)C(c2cccc(C)c2)N(C)C)c1

化学属性

Mol. Weight337.55
Mol. FormulaC23H31NO

别名和识别编码

Chemical NameKetone, 3,3-dimethyl-4-(dimethylamino)-4-(m-tolyl)butyl m-tolyl
Chemicalbook IDCB92364349
Wiswesser Line Notation1N1&YR C1&X1&1&2VR C1
Synonym 3,3-Dimethyl-4-(dimethylamino)-4-(m-tolyl)butyl m-tolyl ketone
Beilstein Registry Number2756899
CAS Number3215-88-1
InChIKeyPBMZNCPYXLIKTF-UHFFFAOYSA-N
PubChem Substance ID18581
InChIInChI=1S/C23H31NO/c1-17-9-7-11-19(15-17)21(25)13-14-23(3,4)22(24(5)6)20-12-8-10-18(2)16-20/h7-12,15-16,22H,13-14H2,1-6H3
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安全信息

RTECSOB2868000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1250 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: 9,187,1966

系列性分类

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