Phosphoric acid, 3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl bis(2-chloropropyl) ester

CAS 4482-85-3 MFCD04482853

化学结构图

4482-85-3
SMILES: Cc1c(Cl)c(=O)oc2cc(OP(=O)(OCC(C)Cl)OCC(C)Cl)ccc12

化学属性

Mol. Weight443.66
Mol. FormulaC16H18Cl3O6P

别名和识别编码

Synonym Filicin Filixic acid BBB
Wiswesser Line NotationT66 BOVJ DG E1 IOPO&O1YG1&O1YG1
Chemical NameCoumarin, 3-chloro-7-hydroxy-4-methyl-, bis(2-chloropropyl)phosphate
CAS Number4482-85-3
Chemicalbook IDCB52162501
InChIKeyYPYDHHNOVXXEOE-UHFFFAOYSA-N
PubChem Substance ID20566
InChIInChI=1S/C16H18Cl3O6P/c1-9(17)7-22-26(21,23-8-10(2)18)25-12-4-5-13-11(3)15(19)16(20)24-14(13)6-12/h4-6,9-10H,7-8H2,1-3H3
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安全信息

RTECSGN5425000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 686 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BCPCA6 Biochemical Pharmacology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958-  Volume(issue)/page/year:
   16,1183,1967

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Bird - chicken
DOSE/DURATION           : >800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BCPCA6 Biochemical Pharmacology.  (Pergamon Press Inc., Maxwell House,
   Fairview Park, Elmsford, NY 10523)  V.1-    1958-  Volume(issue)/page/year:
   16,1183,1967

系列性分类

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