5-Hydroxyindole 5-羟基吲哚

CAS 1953-54-4 MFCD00005677

化学结构图

1953-54-4
SMILES: Oc1ccc2[nH]ccc2c1

化学属性

Mol. FormulaC8H7NO
Mol. Weight133.15
Melting Point107-108°C
TSCANo
Density1.327
Boiling Point343.2°C at 760 mmHg

别名和识别编码

Chemical Name5-Hydroxyindole
CAS Number1953-54-4
Alfabeta NameHYDROXYINDOLE 5-
MDL NumberMFCD00005677
Synonym 5-Hydroxyindole {LY} 5-Hydroxyindole {} {LY} 5-Hydroxyindole {} {} {LY} 5-Hydroxyindole {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 5-Hydroxyindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID16054
Beilstein Registry Number112349
EC Number217-782-6
Reaxys-RN112349
Chemical Name Translation5-羟基吲哚
Wiswesser Line NotationT56 BMJ GQ
LabNetwork Molecule IDLN00124535
InChIInChI=1S/C8H7NO/c10-7-1-2-8-6(5-7)3-4-9-8/h1-5,9-10H
Canonical SMILESOC1=CC2=C(C=C1)NC=C2
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分类

  • {SNA} Building Blocks, C7 to C9, Chemical Synthesis, Heterocyclic Building Blocks, Indoles
  • Heterocycles
  • Indole Derivatives
  • Pharmaceuticals
  • Intermediates & Fine Chemicals
  • Aromatics

产品应用

  • 中间体。

相关文献及参考

  • Yamazaki, Y. et al.: Zeitsch. Naturforsch. C: J. Biosci., 65, 49 (2010); Kay, W.W. et al.: Gen. Pharmacol., 8, 201 (1977); Ghebregzabher, M. et al.: J. Chrom. Biomed. Appl., 222, 191 (1981);
  • Beilstein:21(3/4)765

安全信息

Warnings IRRITANT, KEEP COLD
WGK Germany3
GHS Symbol
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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
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
RTECSNM2430000
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
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 Wear suitable protective clothing 穿戴适当的防护服;
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
Hazard Codes Xi
Storage condition 2-8°C {LY} 2-8°C <0°C <;0 {} {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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique.
   (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France)
   V.9-    1974-  Volume(issue)/page/year: 9,453,1974

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 56 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#01920

其他信息

  • 图谱信息:5-羟基吲哚(1953-54-4)核磁图( 1 HNMR) 5-羟基吲哚(1953-54-4)质谱(MS) 5-羟基吲哚(1953-54-4)红外图谱(IR2) 5-羟基吲哚(1953-54-4)核磁图( 13 CNMR) 5-羟基吲哚(1953-54-4)红外图谱(IR1)
  • color:beige
  • Sigma Aldrich:1953-54-4(sigmaaldrich)
  • 外观性质:类白色针状晶体。熔点:106-108 °C
  • 存储注意事项:氮气保护;光敏感
  • 用途一:用作有机中间体
  • TCI Shanghai:5-羟基吲哚 5-Hydroxyindole,>;98.0%(GC)(1953-54-4)
  • 检测方法:HPLC
  • 海关编码:29339990
  • Acros Organics:5-羟基吲哚 5-Hydroxyindole, 97%(1953-54-4)
  • MSDS 信息:5-Hydroxyindole(1953-54-4).msds
  • 上游原料:钯 --> N,N-二甲基甲酰胺二甲基缩醛 --> 溴化苄 --> 赤血盐 --> 4-硝基间甲苯酚
  • 敏感性:Light Sensitive
  • Alfa Aesar:5-羟基吲哚,98+% 5-Hydroxyindole, 98+%(1953-54-4)
  • MOL 文件:1953-54-4.mol
  • 5-羟基吲哚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 H0252 5-羟基吲哚 5-Hydroxyindole 100MG 166元 2014/06/02 H0252 5-羟基吲哚 5-Hydroxyindole 1G 585元 2014/06/02 H0252 5-羟基吲哚 5-Hydroxyindole 5G 2310元

系列性分类


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