2,3,4,9-Tetrahydro-1H-carbazole 1,2,3,4-四氢咔唑

CAS 942-01-8 MFCD00004959

化学结构图

942-01-8
SMILES: c1ccc2c3c([nH]c2c1)CCCC3

化学属性

Mol. FormulaC12H13N
Mol. Weight171.24
Melting Point118-120°C
TSCANo
Boiling Point325-330°C at 760 mmHg

别名和识别编码

Chemical Name2,3,4,9-Tetrahydro-1H-carbazole
MDL NumberMFCD00004959
CAS Number942-01-8
EC Number213-385-7
Beilstein Registry Number133771
PubChem Substance ID13664
Alfabeta NameTETRAHYDROCARBAZOLE H23491---,,,
Synonym 2,3,4,9-Tetrahydro-1H-carbazole {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-carbazole {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,9-Tetrahydro-1H-car
InChIKeyHYKFPJAARRNNRX-UHFFFAOYSA-N
Chemical Name Translation1,2,3,4-四氢咔唑
Reaxys-RN133771
LabNetwork Molecule IDLN00175886
InChIInChI=1S/C12H13N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1,3,5,7,13H,2,4,6,8H2
Canonical SMILESC1(NC2=C3C=CC=C2)=C3CCCC1
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分类

  • {SNA} Building Blocks, Carbazoles, Chemical Synthesis, Heterocyclic Building Blocks

相关文献及参考

  • Deprotonation with excess superbasic n-BuLi/KO-t-Bu to give the N,ɑ-dianion has been studied in a variety of ether solvents. Formation of substantial amounts of the ɑ-ethyl derivative was observed with Et2O and THF, and also, remarkably, with various alkyl methyl ethers; e.g. in n-BuOMe, the ɑ-ethyl product was obtained in 60% yield. The ethyl group originates from the interaction of the solvent with the strong base, confirmed by the detection of ethylene in the absence of the tetrahydrocarbazole substrate: J. Org. Chem., 60, 8334 (1995). ɑ-Ethylation also occurred with 2-ethylindole, but not with 2-methyl- or 2-isopropyl analogues.
  • Photooxygenation with singlet oxygen, followed by reduction of the expected hydroperoxide to the allylic alcohol, is accompanied by ring contraction to a spiro ketone. The same product is formed in high yield on treatment of the spiroketone with mineral acid: J. Org. Chem., 61, 810 (1996):

安全信息

RTECSFE6300000
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;
  • S37 Wear suitable gloves 戴适当手套;
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/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
WGK Germany2
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。
  • P302+P352+P332+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P332+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
  • H303 May be harmfully swallowed 吞食可能有害
Signal word Warning
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Warnings IRRITANT
Hazard Codes Xi
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

系列性分类


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