2-Methyl-1-propylbutyrate 丁酸-2-甲基丙酯

CAS 539-90-2 MFCD00027134

化学结构图

539-90-2
SMILES:

化学属性

Mol. FormulaC8H16O2
Mol. Weight144.21
Refractive index1.4020 to 1.4050
Vapor Density5 (vs air)
Boiling Point156.3°C at 760 mmHg
Density0.861
Flash Point49°C(lit.)
Melting Point-88.07 °C

别名和识别编码

Chemical Name2-Methyl-1-propylbutyrate
Synonym 2-Methyl-1-propylbutyrate {LY} 2-Methyl-1-propylbutyrate {} {LY} 2-Methyl-1-propylbutyrate {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methyl-1-propylbutyrate {} {} {} {} {} {} {}
MDL NumberMFCD00027134
CAS Number539-90-2
PubChem Substance ID87563760
EC Number208-729-8
Chemical Name Translation丁酸-2-甲基丙酯
Reaxys-RN1747322
Merck Number5136
Beilstein Registry Number1747322
Wiswesser Line Notation3VO1Y1&1
LabNetwork Molecule IDLN00226176
Canonical SMILESCCCC(=O)OCC(C)C
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分类

  • {SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, H-J, Halal Certified Products, I-L, I-N, Kosher Certified Products
  • {SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, Halal Certified Products, I-L, I-N, Kosher Certified Products
  • {SNA} Alphabetical Listings, Certified Food Grade Products, Certified Natural Products, Flavors and Fragrances, I-L, I-N, Kosher Certified Products
  • {SNA} Alphabetical Listings,
  • {SNA} Alphabetical Listings, Certified Food Grade Products, Certified Natural Products,
  • {SNA} Alphabetical Listings,

相关文献及参考

  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.
  • Short: IV/15A Title: Diffusion in Gases, Liquids and Electrolytes: Gases in Gases, Liquids and their Mixtures Author: Winkelmann, J Editor: Lechner, Manfred Dieter Source: Landolt-Börnstein, New Series Volume: IV/15A Year: 2007 Keyword: binary mixture; diffusion; electrolyte; gas; liquid; quaternary mixture; self-diffusion; supercritical fluid system; ternary mixture; vapor ISBN: 978-3-540-62429-5 (print) ISBN: 978-3-540-49718-9 (online) Internet Resource: doi:10.1007/978-3-540-49718-9 RefComment: VIII, 409 p., Hardcover RefComment: Written for: Science and engineers in the fields of physics, chemistry, physical chemistry, and material sciences Abstract: Diffusion – defined as mass, amount, or particle transport process – is the most essential transport property besides viscosity and thermal conductivity. Diffusion is widely used in nature, technical and scientific applications, ranging from diffusion in all kinds of gases, liquids, solids, electrolytes and their mixtures. Due to the large amount of data, the volume LB IV/15 "Diffusion in Gases, Liquids, and Electrolytes" is divided into three subvolumes. Part A: Gases in Gases, Liquids and their Mixtures; Part B: Liquids in Liquids and Li

安全信息

GHS Symbol
WGK Germany2
Hazard statements
  • H400 Verytoxictoaquaticlife 对水生生物毒性非常大。
  • H226 Flammable liquid and vapour 易燃液体和蒸气
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSET5020000
Signal word
Precautionary statements
  • 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。
  • P303+P361+P353
  • P332+P313
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P370+P378
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P241+P242+P243
Safety Statements
Risk Statements
Hazard Codes N
Hazard Class3
UN Number
Packing GroupII 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,833,1979

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >5 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 17,833,1979

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 9520 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   IMSUAI Industrial Medicine and Surgery.  (Northbrook, IL)  V.18-42, 1949-73.
    For publisher information, see IOHSA5.  Volume(issue)/page/year: 41,31,1972

Storage condition

系列性分类

  1. Application Areas 应用领域分类
  2. Flavors and Fragrances 香精香料
  3. Kosher Certified Products - Flavors and Fragrances
  4. I-N - Kosher Certified Products

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