(3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone (3,4-二羟基-5-硝基苯基)(2-氟苯基)甲酮

CAS 125628-97-9 MFCD00078597

化学结构图

125628-97-9
SMILES: [O-][N+](=O)C1C=C(C=C(O)C=1O)C(=O)C1=CC=CC=C1F

化学属性

Mol. FormulaC13H8FNO5
Mol. Weight277.20

别名和识别编码

Chemical Name(3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone
Synonym (3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone 2′-Fluoro-3,4-dihydroxy-5-nitrobenzophenone 2'-Fluoro-3,4-dihydroxy-5-nitrobenzophenone OR 1139 Ro 41-0960
MDL NumberMFCD00078597
PubChem Substance ID24278193
CAS Number125628-97-9
Chemical Name Translation(3,4-二羟基-5-硝基苯基)(2-氟苯基)甲酮
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分类

  • {SNA} Bioactive Small Molecule Alphabetical Index, Catechol-O-methyltransferase, Enzyme Inhibitors, Neuroscience, Neurotransmission, Neurotransmitter Metabolism, R, 生物活性小分子, 细胞信号转导和神经科学, 细胞生物学
  • {SNA} Bioactive Small Molecules, Catechol-O-methyltransferase, Ce

相关文献及参考

  • Borgulya, et al., Catechol-O-methyltransferase-inhibiting pyrocatechol derivatives: Synthesis and structure-activity studies. Helv. Chim. Acta 72 , 952, (1989)

安全信息

RTECSPC4952300
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 136 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   PHTOEH Pharmacology and Toxicology (Copenhagen).  (Munksgaard International
   Pub., POB 2148, DK-1016 Copenhagen K, Denmark)  V.60-    1987-
   Volume(issue)/page/year: 69,64,1991

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 312 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   HCACAV Helvetica Chimica Acta.  (Verlag Helvetica Chimica Acta, Postfach,
   CH-4002 Basel, Switzerland) V.1-    1918-  Volume(issue)/page/year:
   72,952,1989

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物
  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Cell Signaling and Neuroscience - Cell Biology
  4. Neuroscience - Cell Signaling and Neuroscience
  5. Neurotransmission - Neuroscience
  6. Neurotransmitter Metabolism - Neurotransmission
  7. Enzyme Inhibitors - Neurotransmitter Metabolism
  8. Catechol-O-methyltransferase - Enzyme Inhibitors

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