5-Aminotropolone 5-氨基-2-羟基环庚三烯-2,4,6-三烯-1-酮

CAS 7021-46-7 MFCD07021467

化学结构图

7021-46-7
SMILES: Nc1ccc(O)c(=O)cc1

化学属性

Mol. FormulaC7H7NO2
Mol. Weight137.13598
Melting Point177.25 °C
Boiling Point251.96 °C at 760 mmHg

别名和识别编码

Chemical Name5-amino-2-hydroxycyclohepta-2,4,6-trien-1-one
Synonym 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6-trien-1-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Amino-2-hydroxycyclohepta-2,4,6
CAS Number7021-46-7
Beilstein Registry Number1524779
Chemicalbook IDCB72400601
InChIKeySJJUTRFFONLOHZ-UHFFFAOYSA-N
PubChem Substance ID23450
InChIInChI=1S/C7H7NO2/c8-5-1-3-6(9)7(10)4-2-5/h1-4H,8H2,(H,9,10)
LabNetwork Molecule IDLN04690859
Chemical Name Translation5-氨基-2-羟基环庚三烯-2,4,6-三烯-1-酮
Canonical SMILESO=C(C=C1)C(O)=CC=C1N
MDL NumberMFCD00242626
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安全信息

RTECSGU3829500 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 230 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - analgesia
   Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
   YKKZAJ Yakugaku Zasshi.  Journal of Pharmacy.  (Nippon Yakugakkai, 2-12-15
   Shibuya, Shibuya-ku, Tokyo 150, Japan)  No.1-    1881-
   Volume(issue)/page/year: 91,550,1971

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 521 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - analgesia
   Nutritional and Gross Metabolic - body temperature decrease
REFERENCE :
   YKKZAJ Yakugaku Zasshi.  Journal of Pharmacy.  (Nippon Yakugakkai, 2-12-15
   Shibuya, Shibuya-ku, Tokyo 150, Japan)  No.1-    1881-
   Volume(issue)/page/year: 91,550,1971

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 175 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   YKKZAJ Yakugaku Zasshi.  Journal of Pharmacy.  (Nippon Yakugakkai, 2-12-15
   Shibuya, Shibuya-ku, Tokyo 150, Japan)  No.1-    1881-
   Volume(issue)/page/year: 92,19,1972

Storage condition

系列性分类

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