7-Azaindole 7-氮杂吲哚

CAS 271-63-6 MFCD00005606

化学结构图

271-63-6
SMILES: c1cnc2[nH]ccc2c1

化学属性

Mol. FormulaC7H6N2
Mol. Weight118.14
Melting Point105-107°C
TSCANo
Boiling Point273.8°C at 760 mmHg
Density1.422
Flash Point270°C

别名和识别编码

Chemical Name7-Azaindole
CAS Number271-63-6
Alfabeta NameAZAINDOLE 7-
MDL NumberMFCD00005606
Synonym 7-Azaindole {LY} 7-Azaindole {} {LY} 7-Azaindole {} {} {LY} 7-Azaindole {} {} {} {LY} 7-Azaindole {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} { {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 7-Azaindole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
EC Number205-981-0
Beilstein Registry Number109667
PubChem Substance ID9222
Chemical Name Translation7-氮杂吲哚
Reaxys-RN109667
Wiswesser Line NotationT56 BM INJ
LabNetwork Molecule IDLN00007753
InChIInChI=1S/C7H6N2/c1-2-6-3-5-9-7(6)8-4-1/h1-5H,(H,8,9)
Canonical SMILESC12=NC=CC=C1C=CN2
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分类

  • {SNA} Azaindoles, Building Blocks, C7 to C9, Chemical Synthesis, Heterocyclic Building Blocks, Indoles
  • {SA} Azaindoles, Building Blocks, C7 to C9, Chemical Synthesis, Heterocyclic Building Blocks, Indoles
  • Azaindoles, Building Blocks, C7 to C9, Chemical Synthesis, Heterocyclic Building Blocks, Indoles
  • {uni_hamburg} no charge; nitrogen heterocycle; aromatic; large ring; fused rings; 5ring; 6ring; 9ring; 1fragment

产品应用

  • 最新用于合成氮杂血清素的原料。 此杂环分子可用作药物结构单元。

相关文献及参考

  • Sikazwe, D., et al.: Bioorg. Med. Chem., 17, 1716 (2009),
  • Stump, C., et al.: Bioorg. Med. Chem. Lett., 19, 214 (2009),
  • 1. Wang, Xin; et al. J. Org. Chem. 71 , 4021-4023, (2006) 摘要
  • J. Am. Chem. Soc. 128 , 14426, (2006) 摘要
  • FT-IR 2 (3), 3614:D / FT-IR 1 (2), 682:B / FT-NMR 1 (3), 166:A / IR-Spectra (3), 1264:B / IR-Spectra (2), 1099:C / NMR-Reference 2 (2), 551:D / RegBook 1 (2), 2427:H / Sigma FT-IR 1 (2), 295:B / Structure Index 1 , 385:B:1
  • Short: II/24B Title: Molecular Constants mostly from Microwave, Molecular Beam, and Sub-Doppler Laser Spectroscopy: Rotational, Centrifugal Distortion and Related Constants of Diamagnetic Asymmetric Top Molecules Author: Demaison, J.; Vogt, J.; Wlodarczak, G. Editor: Hüttner, W. Source: Landolt-Börnstein, New Series Volume: II/24B Year: 2000 Keyword: Diamagnetics Diatomics; Linear Symmetric Rotors; Molecular Constants; Molecules ISBN: 3-540-65345-7 ISBN: 978-3-540-65345-5 Internet Resource: DOI:10.1007/b58835 RefComment: VIII, 525 pages. Hardcover Abstract: Volume II/24 presents the spectroscopic data on diamagnetic and paramagnetic molecules as well as on molecular ions and radicals up to date considering the publications up to and partly including 1997. The spectroscopic information collected in this volume has been obtained principally from gas phase microwave measurements. Volume II/24 is a supplement to volumes II/4, II/6, II/14, and II/19 and is planned to appear in five subvolumes, the last of which will contain the substance index taking into account all molecules worked at since 1967 in the volumes mentioned and will provide cross references to and betwee
  • Glycosylation at the pyrrole nitrogen has been carried out under phase-transfer conditions to give nucleoside analogues: Heterocycles, 29, 795 (1989).
  • For a review of the chemistry of azaindoles, see: Russ. Chem. Rev., 49, 428 (1980).

安全信息

Warnings IRRITANT
RTECSUY8710000
WGK Germany3
Hazard Codes Xn Xi,Xn Xi
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Signal word Danger Warning
GHS Symbol
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;
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置;
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36 Irritating to eyes 刺激眼睛
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
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。
  • P302+P350
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P332+P313
  • 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
  • H318 Causes serious eye damage 严重伤害眼睛
  • H302 Harmful if swallowed 吞食有害
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 490 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 6,480,1963

其他信息

  • 图谱信息:7-氮杂吲哚(271-63-6)红外图谱(IR2) 7-氮杂吲哚(271-63-6)红外图谱(IR1) 7-氮杂吲哚(271-63-6)核磁图( 13 CNMR) 7-氮杂吲哚(271-63-6)质谱(MS) 7-氮杂吲哚(271-63-6)核磁图( 1 HNMR)
  • TCI Shanghai:1H-吡咯[2,3-b]吡啶 1H-Pyrrolo[2,3-b]pyridine,>;98.0%(GC)(T)(271-63-6)
  • MOL 文件:271-63-6.mol
  • 7-氮杂吲哚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P1117 1H-吡咯[2,3-b]吡啶 1H-Pyrrolo[2,3-b]pyridine 5G 180元 2014/06/02 P1117 1H-吡咯[2,3-b]吡啶 1H-Pyrrolo[2,3-b]pyridine 25G 558元 2010/06/21 105100010 7-氮杂吲哚 7-Azaindole 98% 1 GR 278元
  • MSDS 信息:1H-Pyrrolo[2,3-b]pyridine(271-63-6).msds
  • 用途一:用作有机合成试剂
  • Alfa Aesar:7-氮杂吲哚,98% 7-Azaindole, 98%(271-63-6)
  • Acros Organics:7-氮杂吲哚 7-Azaindole, 98%(271-63-6)
  • 下游产品:5-溴-7-氮杂吲哚 --> 4-溴-7-氮杂吲哚 --> 6-氯-1H-吡咯并[2,3-B]吡啶 --> 6-溴-1H-吡咯并[2,3-B]吡啶 --> 4-氯-7-氮杂吲哚 --> 7-氧代-7-氮杂吲哚
  • 海关编码:29339990
  • Sigma Aldrich:271-63-6(sigmaaldrich)

系列性分类


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