Cyclopropanecarboxylic Acid 环丙甲酸

CAS 1759-53-1 MFCD00001287

化学结构图

1759-53-1
SMILES:

化学属性

Mol. FormulaC4H6O2
Mol. Weight86.09
Density1.081
Refractive index1.4370 to 1.4400
Boiling Point183°C at 760 mmHg
Melting Point14-17°C
Flash Point72°C
TSCAYes

别名和识别编码

Chemical NameCyclopropanecarboxylic Acid
CAS Number1759-53-1
Alfabeta NameCYCLOPROPANECARBOXYLICACID
MDL NumberMFCD00001287
Synonym Cyclopropylcarboxylic acid {LY} Cyclopropylcarboxylic acid {} {LY} Cyclopropylcarboxylic acid {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Cyclopropylcarboxylic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
EC Number217-162-5
Beilstein Registry Number969839
PubChem Substance ID87565516
Reaxys-RN969839
Chemical Name Translation环丙甲酸
Wiswesser Line NotationL3TJ AVQ
LabNetwork Molecule IDLN00173315
Canonical SMILESO=C(C1CC1)O
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分类

  • {SNA} Building Blocks, C1 to C5, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {Chemicalbook} 农药中间体: 植物生长调节剂中间体
  • {uni_hamburg} no charge; carbocycle; alicycle; 3ring; carboxylic acid; 1fragment

产品应用

  • 多种药物等中间体，亦可作为农药中间体。可用于合成拟除虫菊酯类农药和抗菌新药环丙烷氟哌酸等药物。

相关文献及参考

  • Short: II/25C
  • Beilstein:9,4
  • Short: II/24B

安全信息

Warnings IRRITANT
Signal word Danger
GHS Symbol
WGK Germany3
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；
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时，立即求医（可能时出示标签）；
Risk Statements
  • R34 Causes burns 会导致灼伤
Precautionary statements
  • 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。
  • P234 Keep only in original container. 只保留在原来的容器中。
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • P301+P330+P331+P310
  • P303+P361+P353
  • P303+P361+P353+P310+P363
  • P304+P340+P310
  • P305+P351+P338
  • P305+P351+P338+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P370+P378
  • P390 Absorb spillage to prevent material damage. 吸收溢出物，防止重大损害。
  • P403+P235
  • P405 Store locked up. 上锁保管。
  • P406 Store in corrosive resistant/… container with a resistant inner liner. 存放在耐腐蚀/具有耐性的内衬容器。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H227 Combustible liquid 可燃液体
  • H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
Personal Protective Equipment Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSGZ1100000
Packing GroupII
UN Number 3265 UN 3265 8/PG 2 UN3265
Hazard Codes 8 C C,Xi
Hazard Class8
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 172 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPPMAB Journal of Pharmacy and Pharmacology.  (Pharmaceutical Soc. of Great
   Britain, 1 Lambeth High St., London SEI 7JN, UK)  V.1-    1949-
   Volume(issue)/page/year: 21,85,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 180 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems
   Laboratory, NIOSH Exchange Chemicals.  (Aberdeen Proving Ground, MD 21010)
   Volume(issue)/page/year: NX#03926

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 172 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPPMAB Journal of Pharmacy and Pharmacology.  (Pharmaceutical Soc. of Great
   Britain, 1 Lambeth High St., London SEI 7JN, UK)  V.1-    1949-
   Volume(issue)/page/year: 21,85,1969

其他信息

  • MSDS 信息:Trimethylenecarboxylic acid(1759-53-1).msds
  • Acros Organics:环丙烷羧酸 Cyclopropanecarboxylic acid, 98%(1759-53-1)
  • 海关编码:29162000
  • 用途一:用作医药、农药中间体
  • 上游原料:氯化锌 --> gamma-丁内酯 --> 4-氯丁腈 --> 4-氯丁酰氯 --> 丁酸丁酯 --> 4-氯丁酸甲酯
  • 方法一:其制备方法是以γ-丁内酯为原料，加入无水氯化锌为催化剂，和氯化亚砜于55℃反应12h，减压蒸馏得4-氯丁酰氯。将该酰氯与甲醇在吡啶存在下反应，得到4-氯丁酸甲酯。再将该化合物加入到甲苯中，加入甲醇钠，回流搅拌6h，然后加入NaOH和水，剧烈搅拌回流5h，分出有机层，水层用酸酸化得粗产品，再精馏得产品。
  • MOL 文件:1759-53-1.mol
  • 用途三:有机合成中间体。可用于合成拟除虫菊酯类农药和抗菌新药环丙烷氟哌酸等药物。
  • Alfa Aesar:环丙基甲酸,98% Cyclopropanecarboxylic acid, 98%(1759-53-1)
  • Hazard Note:Irritant/Corrosive
  • 下游产品:1-氨基环丙甲醇 --> 氯菊酯 --> 西司他丁 --> 3-环丙基-1H-吡唑-5-氨基 --> 溴氰菊酯 --> 1R,3R-二溴菊酸 --> 乙氰菊酯 --> 溴甲基环丙烷 --> 3-(1,2,2,2-四溴乙基)-2,2-二甲基环丙烷羧酸 --> 2,2,3,3-四甲基环丙烷羧酸乙酯 --> 环丙基甲酰氯
  • 方法二:1.将4-氯丁腈与研细的氢氧化钠混合均匀，在蒸汽浴上加热，反应即激烈进行。分次加入水，加热搅拌。将反应溶液冷却，加碎冰和浓硫酸的混合物酸化，分出上层粘稠液体（环丙烷羧酸和高聚物的混合物），减压蒸馏，收集94-95℃（3.5kPa）馏分，即为产品环丙烷羧酸，产率74%-79%。2.以γ-丁内酯为原料，在卤化剂与醇的存在下，开环形成γ-氯代丁酸丁酯，在强碱存在下，合环得环丙烷羧酸酯，经水解得环丙烷羧酸。
  • TCI Shanghai:环丙烷羧酸 Cyclopropanecarboxylic Acid,>;98.0%(GC)(1759-53-1)
  • Sigma Aldrich:1759-53-1(sigmaaldrich)
  • 环丙甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0387 环丙烷羧酸 Cyclopropanecarboxylic Acid 25ML 245元 2014/06/02 C0387 环丙烷羧酸 Cyclopropanecarboxylic Acid 500ML 1690元 2010/06/21 111621000 环丙甲酸 Cyclopropanecarboxylic acid 98% 100 GR 1048元
  • 检测方法:GC,NMR
  • 溶于水,溶于乙醇和乙醚,溶于大多数有机溶剂.
  • 用途四:多种药物等中间体，亦可作为农药中间体。可用于合成拟除虫菊酯类农药和抗菌新药环丙烷氟哌酸等药物。
  • 用途二:环丙烷羧酸是植物生长调节剂抗倒酯的中间体，也是医药中间体。

系列性分类

  1. Chemical Synthesis 化学合成
  2. Synthetic Reagents 合成试剂
  3. Organic Acids - Synthetic Reagents
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Isoquinolines 异喹啉
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Quinaldines 奎纳丁
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Quinolines 喹啉
  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. Carboxylic Acids - Carbonyl Compounds
  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. Carboxylic Acids - Carbonyl Compounds
  6. C1 to C5 - Carboxylic Acids
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Halogenated Heterocycles 卤代杂环
  5. Quinolines - Halogenated Heterocycles
  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. Carboxylic Acids
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Simple 3-Membered Ring Compounds 简单三元环化合物

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