3-Methoxyphenylacetic Acid 3-甲氧基苯乙酸

CAS 1798-09-0 MFCD00004334

化学结构图

1798-09-0
SMILES: COc1cccc(CC(=O)O)c1

化学属性

Mol. FormulaC9H10O3
Mol. Weight166.17
Melting Point65-69°C
Density1.179
TSCANo
Solubility略溶于水
Boiling Point305.5°C at 760 mmHg
Appearance 白色结晶粉末。熔点65-68℃。

别名和识别编码

Chemical Name3-Methoxyphenylacetic Acid
CAS Number1798-09-0
Alfabeta NameMETHOXYPHENYLACETICACID 3-
MDL NumberMFCD00004334
Beilstein Registry Number2614004
PubChem Substance ID15719
EC Number217-282-8
Reaxys-RN2614004
Synonym 3-Methoxyphenylacetic acid {LY} 3-Methoxyphenylacetic acid {} {LY} 3-Methoxyphenylacetic acid {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methoxyphenylacetic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation3-甲氧基苯乙酸
Wiswesser Line NotationQV1R CO1
LabNetwork Molecule IDLN00008942
InChIInChI=1S/C9H10O3/c1-12-8-4-2-3-7(5-8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
Canonical SMILESO=C(O)CC1=CC=CC(OC)=C1
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分类

  • Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks
  • {SA} Building Blocks, C9, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis, Organic Building Blocks

相关文献及参考

  • Beilstein:10(2)112

安全信息

Warnings IRRITANT
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。
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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
  • P332+P313
  • P305+P351+P338+P337+P313
WGK Germany3
GHS Symbol
Signal word
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
Hazard Codes Xi
RTECSAI8940000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • 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；
  • S37 Wear suitable gloves 戴适当手套；
  • 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；
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
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#04363

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 图谱信息:3-甲氧基苯乙酸(1798-09-0)红外图谱(IR2) 3-甲氧基苯乙酸(1798-09-0)核磁图( 1 HNMR) 3-甲氧基苯乙酸(1798-09-0)红外图谱(IR1) 3-甲氧基苯乙酸(1798-09-0)核磁图( 13 CNMR) 3-甲氧基苯乙酸(1798-09-0)质谱(MS)
  • 下游产品:3-甲氧基苯基乙酰氯
  • MSDS 信息:3-Methoxyphenylacetic acid(1798-09-0).msds
  • Acros Organics:3-甲氧基苯乙酸 3-Methoxyphenylacetic acid, 99.5%(1798-09-0)
  • 海关编码:29189090
  • Alfa Aesar:3-甲氧基苯乙酸,97% 3-Methoxyphenylacetic acid, 97%(1798-09-0)
  • Sigma Aldrich:1798-09-0(sigmaaldrich)
  • Hazard Note:Irritant
  • MOL 文件:1798-09-0.mol
  • 3-甲氧基苯乙酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0858 3-甲氧基苯乙酸 3-Methoxyphenylacetic Acid 25G 703元 2010/06/21 126011000 3-甲氧基苯乙酸 3-Methoxyphenylacetic acid 99.5% 100 GR 2721元 2010/06/21 126010250 3-甲氧基苯乙酸 3-Methoxyphenylacetic acid 99.5% 25 GR 942元
  • TCI Shanghai:3-甲氧基苯乙酸 3-Methoxyphenylacetic Acid,>;98.0%(T)(1798-09-0)

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. Arenes 芳烃
  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. C9 - Carboxylic Acids
  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
  6. C8