Methyl 4-nitrobutyrate 硝基丁酸甲酯

CAS 13013-02-0 MFCD00007408

化学结构图

13013-02-0
SMILES: COC(=O)CCC[N+]([O-])=O

化学属性

Mol. FormulaO2N(CH2)3CO2CH3
Mol. Weight147
Density1.149 g/mL at 25 °C(lit.)
Boiling Point106-110 °C/9 mmHg(lit.)
Refractive indexn20/D 1.438(lit.)

别名和识别编码

Chemical NameMethyl 4-nitrobutyrate
CAS Number13013-02-0
Synonym 4-Nitrobutanoic Acid Methyl Ester Methyl 4-Nitrobutyrate NSC 126459 4-Nitrobutyric acid methyl ester Methyl 4-Nitrobutanoate 4-硝基丁酸甲酯
Beilstein Registry Number1766154
PubChem Substance ID24853657
EC Number235-866-0
MDL NumberMFCD00007408
Chemical Name Translation硝基丁酸甲酯
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分类

  • Building Blocks, C2 to C5, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks
  • {SNA} Building Blocks, C2 to C5, Carbonyl Compounds, Chemical Synthesis, Esters, Organic Building Blocks

产品应用

  • Butyric acid derivative. Displays some anti-inflammatory activity.

相关文献及参考

  • Beil. 2 ,IV,840
  • Aldrich MSDS 1 , 1277:D / Corp MSDS 1 (2), 2392:B / FT-IR 1 (1), 681:C / FT-IR 2 (1), 1134:A / FT-NMR 1 (1), 1071:A / RegBook 1 (1), 777:J / Sigma FT-IR 1 (2), 782:C / Structure Index 1 , 121:B:3 / Vapor Phase 3 , 736:A

安全信息

WGK Germany3
RTECSET5950970
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1 gm/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: 30,56,1967

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Nitro Compounds 硝基化合物
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters - Carbonyl Compounds
  6. C2 to C5 - Esters
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Esters
  6. C12 to C63

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