Dibutyl sulfoxide 二丁基亚砜

CAS 2168-93-6 MFCD00002093

化学结构图

2168-93-6
SMILES: CCCCS(=O)CCCC

化学属性

Mol. FormulaC8H18OS
Mol. Weight162.29
Density0.832 g/mL at 25 °C(lit.)
Boiling Point250 °C at 760 mmHg
Melting Point32.6 °C
Refractive indexn20/D 1.467(lit.)
Flash Point121°(249°F)
TSCANo

别名和识别编码

Chemical NameDibutyl sulfoxide
Synonym 1-(Butylsulfinyl)butane {LY} 1-(Butylsulfinyl)butane {} {LY} 1-(Butylsulfinyl)butane {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(Butylsulfinyl)butane
MDL NumberMFCD00002093
PubChem Substance ID16568
CAS Number2168-93-6
EC Number218-511-4
Reaxys-RN1747425
Beilstein Registry Number1,371
Chemical Name Translation二丁基亚砜
InChIKeyLOWMYOWHQMKBTM-UHFFFAOYSA-N
Wiswesser Line NotationOS4&4
LabNetwork Molecule IDLN01741486
InChIInChI=1S/C8H18OS/c1-3-5-7-10(9)8-6-4-2/h3-8H2,1-2H3
Canonical SMILESCCCCS(CCCC)=O
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分类

  • {uni_hamburg} no charge; sulfoxide; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Organic Building Blocks, Sulfoxides, Sulfur Compounds

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A),
  • Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Beil. 1 ,371
  • FT-IR 1 (1), 879:B / FT-IR 2 (1), 1492:C / FT-NMR 1 (1), 1417:B / IR-Spectra (2), 469:C / IR-Spectra (3), 529:C / NMR-Reference 2 (2), 781:B / RegBook 1 (1), 1043:B / Structure Index 1 , 162:B:1

安全信息

WGK Germany3
RTECSEK5700000
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 450 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   IJRBA3 International Journal of Radiation Biology and Related Studies in
   Physics, Chemistry and Medicine.  (Taylor & Francis Inc., 242 Cherry St.,
   Philadelphia, PA 19106)  V.1-    1959-  Volume(issue)/page/year: 3,41,1961

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 378 mg/kg
TOXIC EFFECTS :
   Lungs, Thorax, or Respiration - dyspnea
REFERENCE :
   PHARAT Pharmazie.  (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18,
   Berlin DDR-1020, Ger. Dem. Rep.)  V.1-    1946-  Volume(issue)/page/year:
   26,96,1970

其他信息

  • Alfa Aesar:二丁基亚砜,97% Di-n-butyl sulfoxide, 97%(2168-93-6)
  • Acros Organics:n-Butyl sulfoxide, tech., 93%(2168-93-6)
  • TCI Shanghai:二正丁基亚砜 Dibutyl Sulfoxide,>;96.0%(GC)(2168-93-6)
  • 图谱信息:正丁基亚砜(2168-93-6)红外图谱(IR1) 正丁基亚砜(2168-93-6)红外图谱(IR2)
  • 正丁基亚砜价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D1173 二丁基亚砜 Dibutyl Sulfoxide 25G 677元 2010/06/21 108040250 正丁基亚砜 n-Butyl sulfoxide 93%, tech. 25 ML 1132元 2010/05/25 B23672 二丁基亚砜, 97% Di-n-butyl sulfoxide, 97% 5g 210元
  • Sigma Aldrich:2168-93-6(sigmaaldrich)
  • 敏感性:Hygroscopic
  • MOL 文件:2168-93-6.mol

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. Sulfur Compounds 硫化合物
  5. Sulfoxides - Sulfur Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Sulfur Compounds 硫化合物
  5. Sulfoxides - Sulfur Compounds