2,3-Dimethoxybenzoic Acid 2,3-二甲氧基苯甲酸

CAS 1521-38-6 MFCD00002432

化学结构图

1521-38-6
SMILES: COc1cccc(C(=O)O)c1OC

化学属性

Mol. FormulaC9H10O4
Mol. Weight182.18
Melting Point120-122°C
TSCANo
Density1.214
Stability对湿度敏感
Solubilityslightly soluble
Boiling Point275.56 °C at 760 mmHg

别名和识别编码

Chemical Name2,3-Dimethoxybenzoic Acid
CAS Number1521-38-6
Alfabeta NameDIMETHOXYBENZOICACID 23-,
MDL NumberMFCD00002432
Beilstein Registry Number10(3)1363
PubChem Substance ID15204
EC Number216-188-4
Reaxys-RN2210858
Synonym 2,3-Dimethoxybenzoic acid {LY} 2,3-Dimethoxybenzoic acid {} {LY} 2,3-Dimethoxybenzoic acid {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} { {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3-Dimethoxybenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation2,3-二甲氧基苯甲酸
InChIKeyFODBVCSYJKNBLO-UHFFFAOYSA-N
LabNetwork Molecule IDLN00174644
InChIInChI=1S/C9H10O4/c1-12-7-5-3-4-6(9(10)11)8(7)13-2/h3-5H,1-2H3,(H,10,11)
Canonical SMILESC1=CC=C(C(=C1OC)OC)C(O)=O
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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

产品应用

  • 有机合成。

相关文献及参考

  • Beilstein:10(3)1363
  • The acid chloride readily forms the oxazoline, which can be coupled with Mg or Li reagents (alkyl or aryl), with displacement of the o-methoxy group, to give alkylated or arylated products: Org. Synth. Coll., 9, 258 (1998); for an example, see 2-Amino-2-methyl-1-propanol, A17814.

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。
  • P302+P352+P332+P313+P362+P364
  • 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
RTECSDG8598700
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Safety Statements
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
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
TYPE OF TEST            : LD - Lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : >500 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NCNSA6 National Academy of Sciences, National Research Council,
   Chemical-Biological Coordination Center, Review.  (Washington, DC)
   Volume(issue)/page/year: 5,16,1953

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : >800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
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: 196,478,1976

其他信息

  • MSDS 信息:2,3-Dimethoxybenzoic acid(1521-38-6).msds
  • 用途一:医药中间体
  • 海关编码:29189090
  • 微溶于水。有刺激性。
  • 下游产品:2-(7-羟基苯并呋喃-3-基)乙酸甲酯 --> 7-甲氧基-3(2H)-苯并呋喃酮
  • 2,3-二甲氧基苯甲酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010366 2,3-二甲氧基苯甲酸;邻二甲氧基苯甲酸; 2,3-二甲氧基苯酸 50g 198元 2011/04/16 D0630 2,3-二甲氧基苯甲酸 2,3-Dimethoxybenzoic Acid 500G 7670元 2011/04/16 D0630 2,3-二甲氧基苯甲酸 2,3-Dimethoxybenzoic Acid 25G 948元
  • Hazard Note:Irritant
  • MOL 文件:1521-38-6.mol
  • 外观性质:白色至浅米黄色结晶粉末。微溶于水。有刺激性。熔点:122-124℃
  • Alfa Aesar:2,3-二甲氧基苯甲酸,99% 2,3-Dimethoxybenzoic acid, 99%(1521-38-6)
  • Sigma Aldrich:1521-38-6(sigmaaldrich)
  • 图谱信息:2,3-二甲氧基苯甲酸(1521-38-6)Raman光谱 2,3-二甲氧基苯甲酸(1521-38-6)红外图谱(IR1) 2,3-二甲氧基苯甲酸(1521-38-6)红外图谱(IR2) 2,3-二甲氧基苯甲酸(1521-38-6)质谱(MS) 2,3-二甲氧基苯甲酸(1521-38-6)核磁图( 1 HNMR) 2,3-二甲氧基苯甲酸(1521-38-6)核磁图( 13 CNMR)
  • TCI Shanghai:2,3-二甲氧基苯甲酸 2,3-Dimethoxybenzoic Acid,>;98.0%(GC)(T)(1521-38-6)
  • Acros Organics:2,3-二甲氧基苯甲酸 2,3-Dimethoxybenzoic acid, 99%(1521-38-6)

系列性分类


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