Bonafton 6-溴萘-1,2-二酮

CAS 6954-48-9 MFCD00464116

化学结构图

6954-48-9
SMILES: O=C1C=Cc2cc(Br)ccc2C1=O

化学属性

Mol. FormulaC10H5BrO2
Mol. Weight237.05
Melting Point168 °C
Boiling Point363.7±42.0 °C at 760 mmHg

别名和识别编码

Chemical NameBonafton
CAS Number6954-48-9
Alfabeta NameBROMONAPHTHALENEDIONE 612---,
MDL NumberMFCD00464116
Chemical Name Translation6-溴萘-1,2-二酮
InChIKeyMXWZRRPNVLCHMY-UHFFFAOYSA-N
Wiswesser Line NotationL66 BVVJ HE
Synonym Bonaphthone {LY} Bonaphthone {} {LY} Bonaphthone {} {} {LY} Bonaphthone {} {} {} {LY} Bonaphthone {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Bonaphthone {} {} {}
Beilstein Registry Number1944551
LabNetwork Molecule IDLN00158222
PubChem Substance ID23384
InChIInChI=1S/C10H5BrO2/c11-7-2-3-8-6(5-7)1-4-9(12)10(8)13/h1-5H
Canonical SMILESC1=CC(=O)C(=O)C2=CC=C(C=C12)Br
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安全信息

Warnings IRRITANT
RTECSQL7400000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 130 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 39,628,1976

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3900 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 43,337,1980

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 900 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 39,628,1976

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 9 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 39,

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 700 mg/kg
SEX/DURATION            : female 12 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetal death
   Reproductive - Specific Developmental Abnormalities - other developmental
   abnormalities
REFERENCE :
   FATOAO Farmakologiya i Toksikologiya (Moscow).  For English translation, see
   PHTXA6 and RPTOAN. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.2-   
   1939-  Volume(issue)/page/year: 41,109,1978

Storage condition

系列性分类

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