Indole-5-carboxaldehyde 5-吲哚甲醛

CAS 1196-69-6 MFCD02093664

化学结构图

1196-69-6
SMILES: O=Cc1ccc2[nH]ccc2c1

化学属性

Mol. FormulaC9H7NO
Mol. Weight145.16
Melting Point100-103°C
Density1.422
TSCANo
Stability对空气敏感
Boiling Point339.1±15.0 °C at 760 mmHg

别名和识别编码

Chemical NameIndole-5-carboxaldehyde
CAS Number1196-69-6
Alfabeta NameINDOLECARBOXALDEHYDE 5--
MDL NumberMFCD02093664
Synonym Indole-5-aldehyde {LY} Indole-5-aldehyde {} {LY} Indole-5-aldehyde {} {} {LY} Indole-5-aldehyde {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Indole-5-aldehyde {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
PubChem Substance ID87577948
EC Number250-023-7
Beilstein Registry Number1524963
Reaxys-RN1524963
Chemical Name Translation5-吲哚甲醛
LabNetwork Molecule IDLN00115451
Canonical SMILESO=CC1=CC=C(NC=C2)C2=C1
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分类

  • {SNA} Aldehydes, Building Blocks, C7 to C9, C9, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Indoles, Organic Building Blocks
  • Aldehydes, Building Blocks, C7 to C9, C9, Carbonyl Compounds, Chemical Synthesis, Heterocyclic Building Blocks, Indoles, Organic Building Blocks

相关文献及参考

  • 1. Katsori, A.-M.; et al. Eur. J. Med. Chem. 46 , 2722, (2011) 摘要
  • 2. Capek, P.; et al. ACS Chem. Neurosci. 2 , 288, (2011) 摘要
  • 3. Cui, M.; et al. J. Med. Chem. 54 , 2225, (2011) 摘要
  • 4. Alvarez, R.; et al. Chem. Eur. J. 17 , 3406, (2011)
  • 5. Balducci, E.; et al. Eur. J. Org. Chem. , 311, (2011)
  • 6. Coumar, M., S.; et al. J. Med. Chem. 52 , 1050, (2009) 摘要
  • Bahara, R. S.; Kulkarni, V. M. , Synthesis, QSAR and hypoglycemic activity of substituted 2,4-thiazolidinedione derivatives Der Pharma Chemica 3 , 164, (2011)
  • J. Org. Chem. 67 , 6256, (2002) 摘要
  • Bioorg. Med. Chem. Lett. 10 , 719, (2000) 摘要
  • Beil. 21 ,8,264

安全信息

Warnings IRRITANT
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。
  • P302+P352+P332+P313+P362+P364
  • 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
Signal word Warning
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
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；
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
  • 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；
  • S37 Wear suitable gloves 戴适当手套；
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置；
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 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen Air Sensitive Keep Cold {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitro

其他信息

  • MOL 文件:1196-70-9.mol
  • Acros Organics:5-吲哚甲醛 Indole-5-carboxaldehyde,98+%(1196-69-6)
  • Sigma Aldrich:1196-70-9(sigmaaldrich)
  • Hazard Note:Irritant/Keep Cold
  • Alfa Aesar:吲哚-5-甲醛,98% Indole-5-carboxaldehyde, 98%(1196-69-6)
  • 敏感性:Air Sensitive
  • TCI Shanghai:吲哚-5-甲醛 Indole-5-carboxaldehyde,>;98.0%(GC)(1196-69-6)
  • MOL 文件:1196-69-6.mol
  • 吲哚-6-甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0743 吲哚-6-甲醛 Indole-6-carboxaldehyde 5G 3220元 2014/06/02 I0743 吲哚-6-甲醛 Indole-6-carboxaldehyde 1G 923元
  • 上游原料:N,N-二甲基甲酰胺 --> 叔丁基锂 --> 5-溴吲哚 --> 氢化钾
  • Sigma Aldrich:1196-69-6(sigmaaldrich)
  • 5-吲哚甲醛价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0674 吲哚-5-甲醛 Indole-5-carboxaldehyde 25G 3990元 2014/06/02 I0674 吲哚-5-甲醛 Indole-5-carboxaldehyde 5G 1210元 2010/06/21 391630010 5-吲哚甲醛 Indole-5-carboxaldehyde 98+% 1 GR 684元
  • 图谱信息:5-吲哚甲醛(1196-69-6)红外图谱(IR1) 5-吲哚甲醛(1196-69-6)红外图谱(IR2) 5-吲哚甲醛(1196-69-6)质谱(MS) 5-吲哚甲醛(1196-69-6)核磁图( 13 CNMR) 5-吲哚甲醛(1196-69-6)核磁图( 1 HNMR)
  • 上游原料:N,N-二甲基甲酰胺 --> 钯 --> 二氧化锰 --> N,N-二甲基甲酰胺二甲基缩醛 --> 三氯化钛 --> 4-甲基-3-硝基苯甲酸甲酯

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Indoles 吲哚
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Heterocyclic Building Blocks 杂环合成砌块
  4. Indolines 吲哚啉
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Aldehydes - Carbonyl Compounds
  6. C9 - Aldehydes
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Indoles

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