1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one 1-(苯并[d][1,3]二噁戊环-5-基)-4,4-二甲基戊-1-烯-3-酮

CAS 2419-68-3 MFCD00017633

化学结构图

2419-68-3
SMILES: CC(C)(C)C(=O)C=Cc1ccc2c(c1)OCO2

化学属性

Mol. FormulaC14H16O3
Mol. Weight232.28
Melting Point91-93 °C
Boiling Point358.8±11.0 °C at 760 mmHg

别名和识别编码

Chemical Name1-(3,4-Methylenedioxyphenyl)-4,4-dimethyl-pent-1-en-3-one
MDL NumberMFCD00017633
CAS Number2419-68-3
Synonym (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {} {LY} (E)-1-(benzo[d][1,3]dioxol-5-yl)-4,4-dimethylpent-1-en-3-one {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation1-(苯并[d][1,3]二噁戊环-5-基)-4,4-二甲基戊-1-烯-3-酮
InChIKeyLXFNQCGNCFRKRR-FNORWQNLSA-N
PubChem Substance ID6444507
InChIInChI=1S/C14H16O3/c1-14(2,3)13(15)7-5-10-4-6-11-12(8-10)17-9-16-11/h4-8H,9H2,1-3H3/b7-5+
Canonical SMILESCC(C)(C)C(=O)/C=C/C1=CC2=C(C=C1)OCO2
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分类

  • {SNA} Building Blocks, C14, Chemical Synthesis, Ethers, Organic Building Blocks, Oxygen Compounds

安全信息

RTECSSB3851700
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >2 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique.
   (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France)
   V.9-    1974-  Volume(issue)/page/year: 13,41,1978

Hazard statements
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H401 Toxictoaquaticlife 对水生生物有毒。
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P302+P352
  • P321 Specific treatment (see … on this label). 具体治疗(见本标签上的)。
  • P333+P313
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition

系列性分类


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