1,1-Diethylurea 1,1-二乙基脲

CAS 634-95-7 MFCD00007960

化学结构图

634-95-7
SMILES: CCN(CC)C(N)=O

化学属性

Mol. FormulaC5H12N2O
Mol. Weight116.16
Melting Point69-71 °C
Boiling Point130 °C at 3 mmHg

别名和识别编码

Chemical Name1,1-Diethylurea
MDL NumberMFCD00007960
PubChem Substance ID12472
CAS Number634-95-7
EC Number211-220-3
Reaxys-RN1747730
Beilstein Registry Number4(4)380
Synonym 1,1-Diethylurea {LY} 1,1-Diethylurea {} {LY} 1,1-Diethylurea {} {} {LY} 1,1-Diethylurea {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,1-Diethylurea {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation1,1-二乙基脲
InChIKeyTUMNHQRORINJKE-UHFFFAOYSA-N
Wiswesser Line NotationZVN2&2
LabNetwork Molecule IDLN01741592
InChIInChI=1S/C5H12N2O/c1-3-7(4-2)5(6)8/h3-4H2,1-2H3,(H2,6,8)
Canonical SMILESO=C(N)N(CC)CC
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分类

  • Building Blocks, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks, Ureas
  • {SNA} Building Blocks, Carbonyl Compounds, Chemical Synthesis, Organic Building Blocks, Ureas
  • {uni_hamburg} no charge; urea; 1fragment

相关文献及参考

  • Beil. 4 ,120
  • FT-IR 2 (1), 1360:D / FT-IR 1 (1), 802:C / FT-NMR 1 (1), 1309:B / RegBook 1 (1), 941:E / Sigma FT-IR 1 (2), 467:C / Structure Index 1 , 146:D:4 / Vapor Phase 3 , 791:A
  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • Short: IV/20B Title: Vapor Pressure and Antoine Coefficients for Oxygen Containing Organic Compounds Author: Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.; Hall, K.R. Editor: Hall, K.R. Source: Landolt-Börnstein, New Series Volume: IV/20B Year: 2000 Keyword: organic compounds; vapor pressure ISBN: 3-540-6496

安全信息

WGK Germany3
RTECSYS9353900
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Hazard Codes Xn
GHS Symbol
Signal word Warning
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2905 mg/kg
TOXIC EFFECTS :
   Behavioral - general anesthetic
   Behavioral - somnolence (general depressed activity)
   Behavioral - ataxia
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 54,188,1935

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西，喝水或吸烟。
  • P301+P312
  • P301+P317
  • P330 Rinse mouth. 漱口
  • P501 Dispose of contents/container to..… 处理内容物/容器.....

其他信息

  • 图谱信息:1,1-二乙基脲(634-95-7)红外图谱(IR3) 1,1-二乙基脲(634-95-7)红外图谱(IR2) 1,1-二乙基脲(634-95-7)质谱(MS) 1,1-二乙基脲(634-95-7)红外图谱(IR1)
  • TCI Shanghai:1,1-二乙基脲 1,1-Diethylurea,>;97.0%(T)(634-95-7)
  • Sigma Aldrich:634-95-7(sigmaaldrich)
  • Acros Organics:1,1-Diethylurea, 97%(634-95-7)
  • 1,1-二乙基脲价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D1567 1,1-二乙基脲 1,1-Diethylurea 25G 884元 2010/06/21 407550250 1,1-二乙基脲 1,1-Diethylurea 97% 25 GR 857元
  • MOL 文件:634-95-7.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. Carbonyl Compounds 羰基化合物
  5. Ureas - Carbonyl Compounds

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