3-Chloropropyl Acetate 3-氯丙基乙酸酯

CAS 628-09-1 MFCD00001000

化学结构图

628-09-1
SMILES: CC(=O)OCCCCl

化学属性

Mol. FormulaC5H9ClO2
Mol. Weight136.58
Refractive indexn20/D 1.429(lit.)
Boiling Point80-81 °C at 30 mmHg
Density1.111 g/mL at 25 °C(lit.)
Flash Point68°C
TSCANo
Appearance 无色液体。沸点163-165℃(99.6kPa),80-81℃(4.0kPa),62-62℃(1.33kPa),相对密度1.250(19/4℃),折光率1.431。溶于乙醚、乙醇、丙酮、不溶于水。

别名和识别编码

Chemical Name3-Chloropropyl acetate
CAS Number628-09-1
PubChem Substance ID24850169
MDL NumberMFCD00001000
Synonym 3-Chloropropyl acetate {LY} 3-Chloropropyl acetate {} {LY} 3-Chloropropyl acetate {} {} {LY} 3-Chloropropyl acetate {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chloropropyl acetate
Chemical Name Translation3-氯丙基乙酸酯
InChIKeyKPOHQIPNNIMWRL-UHFFFAOYSA-N
Wiswesser Line NotationG3OV1
Beilstein Registry Number1745110
LabNetwork Molecule IDLN00239753
Canonical SMILESCC(OCCCCl)=O
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分类

  • {uni_hamburg} no charge; ester; 1fragment
  • 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

相关文献及参考

  • Beil. 2 ,I,58
  • Corp MSDS 1 (1), 849:D / FT-IR 2 (1), 1054:B / FT-NMR 1 (1), 1005:A / RegBook 1 (1), 733:C / Structure Index 1 , 112:C:6 / Vapor Phase 3 , 695:B
  • 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.

安全信息

GHS Symbol
WGK Germany2
Hazard Codes Xi
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSUA8944000
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。
  • P305+P351+P338
Signal word Warning
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S37 Wear suitable gloves 戴适当手套;
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 5290 mg/kg
TOXIC EFFECTS :
   Behavioral - muscle contraction or spasticity
   Gastrointestinal - ulceration or bleeding from stomach
   Liver - other changes
REFERENCE :
   ZHYGAM Zeitschrift fuer die Gesamte Hygiene und Ihre Grenzgebiete.  (VEB
   Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem.
   Rep.)  V.1-    1955-  Volume(issue)/page/year: 26,17,1980

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 3-氯丙基乙酸酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 B25013 3-氯丙基乙酸酯, 98% 3-Chloropropyl acetate, 98% 500g 4536元 2010/05/25 B25013 3-氯丙基乙酸酯, 98% 3-Chloropropyl acetate, 98% 25g 384元 2010/05/25 B25013 3-氯丙基乙酸酯, 98% 3-Chloropropyl acetate, 98% 100g 1151元
  • 方法一:由-3-氯-1-丙醇与乙酰氯反应而得。将乙酰氯慢慢加入3-氯-1-丙醇中,加热回流至不再有氯化氢放出为止,蒸馏得成品,产率为86%。
  • 上游原料:3-氯-1-丙醇
  • Alfa Aesar:3-氯丙基乙酸酯,98% 3-Chloropropyl acetate, 98%(628-09-1)
  • Sigma Aldrich:628-09-1(sigmaaldrich)
  • 用途一:有机合成中间体,用于染料的生产。
  • MOL 文件:628-09-1.mol

系列性分类


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