1,3,5-Trimethoxybenzene 1,3,5-三甲氧基苯

CAS 621-23-8 MFCD00008385

化学结构图

621-23-8
SMILES: COc1cc(OC)cc(OC)c1

化学属性

Mol. FormulaC9H12O3
Mol. Weight168
Flash Point85°(185°F)
TSCAYes
Boiling Point255
Melting Point50-53
Density1.041
Appearance 白色结晶粉末，熔点51-53℃，沸点255℃。 白色针状结晶。熔点210-212℃，溶于乙醇，微溶于丙酮。
Solubilitymethanol: 0.1 g/mL, clear, colorless

别名和识别编码

Chemical Name1,3,5-Trimethoxybenzene
CAS Number621-23-8
Synonym 2-二乙氨基乙基氯 2-chloro-n,n-diethyl-ethanaminhydrochloride {Chemicalbook} 2-氯-1-二乙氨基乙烷盐酸盐 2,4,6-Trimethyl-1,3,5-benzen 1,3,5-TRIMETHOXYBENZENE, 99+% 2-chloroethyl-n,n-diethylaminehydrochloride 1,3,5-TRIMETHOXYBENZENE 3,5-DIME Benzene, 1,3,5-trimethoxy- n,n-diethyl-2-chloroethylaminehydrochloride 3,5-DIMETHOXY 2,4,6-Trimethoxybenzene n,n-diethyl-beta-chloroethylaminehydrochloride 二乙基氨基乙基-2-氯盐酸盐 bis(ethyl)-2-chloroethylaminehydrochloride 2-氯代二乙氨基乙烷盐酸盐 diethyl-beta-chlor {Chem {Chemicalb 2-(二乙基氨基)乙基氯盐酸盐 1,3,5-Trimethoxybenzene/Phloroglucinol trimethyl ether 均三甲氧基苯 Phlor
MDL NumberMFCD00008385
EC Number210-673-4
Beilstein Registry Number1307993
PubChem Substance ID69301
Chemical Name Translation1,3,5-三甲氧基苯
Reaxys-RN1307993
Wiswesser Line Notation1OR CO1 EO1
LabNetwork Molecule IDLN00008330
InChIInChI=1S/C9H12O3/c1-10-7-4-8(11-2)6-9(5-7)12-3/h4-6H,1-3H3
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分类

  • Pharmaceuticals
  • Aromatics
  • Intermediates & Fine Chemicals
  • {SNA} Building Blocks, C9, Chemical Synthesis, Ethers, Organic Building Blocks, Oxygen Compounds

产品应用

  • 医药和有机合成中间体

相关文献及参考

  • Direct dilithiation with n-BuLi/TMEDA gave, after reaction with TMS chloride, the 2,4-disilyl derivative in 85-95% yield: J. Org. Chem., 49, 4657 (1984).
  • Beilstein:6,1101
  • Has been used as the non-transferable group in the conjugate addition of organocuprates. (With Li dialkyl cuprates only one of the two alkyl groups is transferred, with consequent 50% maximum yield.): Chem. Lett., 745 (1988):
  • Chassany, O. et al.: Aliment. Pharmacol. Therap., 25, 1115 (2007); Zhou, P. et al.: Sich. Yix., 31, 420 (2010);

安全信息

RTECSDC2810000
Safety Statements
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H319 Causes serious eye irritation 严重刺激眼睛
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Precautionary statements
  • P305+P351+P338
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
Signal word
Hazard Codes Xn Xn,F Xn,T,Xi,T+
Packing GroupII
Hazard Class4.1
UN Number UN 2811 6.1/PG 2 1325
Storage condition Poison room 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 580 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 3,187,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1480 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 3,187,1969

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 2800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   OYYAA2 Oyo Yakuri.  Pharmacometrics.  (Oyo Yakuri Kenkyukai, CPO Box 180,
   Sendai 980-91, Japan) V.1-    1967-  Volume(issue)/page/year: 3,187,1969

其他信息

  • 用途二:作为有机合成中间体。用于药物胃复康、
  • TCI Shanghai:2-二乙氨基氯乙烷盐酸盐 2-(Diethylamino)ethyl Chloride Hydrochloride,>;98.0%(T)(869-24-9)
  • 方法一:由β-二乙氨基乙醇与氯化亚砜反应而得。
  • 下游产品:1-(3-三氟甲基苯基)哌嗪 --> 1-(2-甲氧苯基)哌嗪
  • 用途二:医药和有机合成中间体
  • 图谱信息:2-二乙氨基氯乙烷盐酸盐(869-24-9)质谱(MS) 2-二乙氨基氯乙烷盐酸盐(869-24-9)红外图谱(IR2) 2-二乙氨基氯乙烷盐酸盐(869-24-9)Raman光谱 2-二乙氨基氯乙烷盐酸盐(869-24-9)红外图谱(IR1)
  • Sigma Aldrich:869-24-9(sigmaaldrich)
  • 海关编码:29211980
  • 不溶于水；溶于大多数常规有机溶剂，溶于甲醇。
  • 用途一:用作医药中间体，用于制造延通心药物等
  • TCI Shanghai:1,3,5-三甲氧基苯 1,3,5-Trimethoxybenzene,>;98.0%(GC)(621-23-8)
  • MSDS 信息:2-Diethylaminoethylchloride hydrochloride(869-24-9).msds
  • Acros Organics:1,3,5-三甲氧基苯 1,3,5-Trimethoxybenzene, 99%(621-23-8)
  • 1,3,5-三甲氧基苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P0250 1,3,5-三甲氧基苯 1,3,5-Trimethoxybenzene 25G 316元 2014/06/02 P0250 1,3,5-三甲氧基苯 1,3,5-Trimethoxybenzene 500G 2550元 2010/06/21 160550100 1,3,5-三甲氧基苯 1,3,5-Trimethoxybenzene 99% 10 GR 294元
  • 海关编码:29093090
  • Sigma Aldrich:621-23-8(sigmaaldrich)
  • MOL 文件:869-24-9.mol
  • 图谱信息:1,3,5-三甲氧基苯(621-23-8)红外图谱(IR1) 1,3,5-三甲氧基苯(621-23-8)核磁图( 1 HNMR) 1,3,5-三甲氧基苯(621-23-8)核磁图( 13 CNMR) 1,3,5-三甲氧基苯(621-23-8)红外图谱(IR2) 1,3,5-三甲氧基苯(621-23-8)Raman光
  • 图谱信息:1,3,5-三甲氧基苯(621-23-8)红外图谱(IR1) 1,3,5-三甲氧基苯(621-23-8)核磁图( 1 HNMR) 1,3,5-三甲氧基苯(621-23-8)核磁图( 13 CNMR) 1,3,5-三甲氧基苯(621-23-8)红外图谱(IR2) 1,3,5-三甲氧基苯(621-23-8)Ra
  • 上游原料:二乙氨基乙醇
  • Acros Organics:2-二乙氨基乙基氯盐酸盐 2-Diethylaminoethylchloride hydrochloride, 99.50%(869-24-9)
  • 2-二乙氨基氯乙烷盐酸盐价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 114030050 2-二乙氨基氯乙烷盐酸盐 2-Diethylaminoethylchloride hydrochloride 99.5% 5 GR 388元 2010/06/21 114032500 2-二乙氨基氯乙烷盐酸盐 2-Diethylaminoethylchloride hydrochloride 99.5% 250 GR 593元 2010
  • 2-二乙氨基氯乙烷盐酸盐价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 1140300

系列性分类

  1. Analytical & Chromatography 分析化学与色谱
  2. Analytical Reagents
  3. Analytical Reagents for General Use - Analytical Reagents
  4. Puriss p.a. - Analytical Reagents for General Use
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Ethers - Oxygen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Amine Salts - Nitrogen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Ethers - Oxygen Compounds
  6. C9 - Ethers
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Nitrogen Compounds 氮化合物
  5. Amidates/Imidates
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Epoxides
  1. Chemical Synthesis 化学合成
  2. Catalysis and Inorganic Chemistry 催化剂和无机化学
  3. Iron
  1. Analytical & Chromatography 分析化学与色谱
  2. Adsorbents, Filter Aids and Drying Agents
  3. Other Drying Agents

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