Isoquinoline N-Oxide 异喹啉-N-氧化物

CAS 1532-72-5 MFCD00006903

化学结构图

1532-72-5
SMILES: [O-][n+]1ccc2ccccc2c1

化学属性

Mol. FormulaC9H7NO
Mol. Weight145
TSCANo
Boiling Point170°/3mm
Melting Point103.0 to 105.0 deg-C
Flash Point170°C/3mm
Density

别名和识别编码

Chemical NameIsoquinoline N-Oxide
CAS Number1532-72-5
Alfabeta NameISOQUINOLINEOXIDE N-
MDL NumberMFCD00006903
Synonym 2-Oxylatoisoquinoline-2-ium 2-Oxylatoisoquinolinium ISOQUINOLIN-N-OXIDE ISOQUINOLINE 2-OXIDE ISOQUINOLINE N-OXIDE ISOQUINOLINE N-OXIDE: 50% W/V IN WATER Isochinolin-N-oxid Isoquinoline 2-oxide Isoquinoline N-oxide Isoquinoline N-oxide, min 50% w/v in water Isoquinoline oxide Isoquinoline, 2-oxide isoquinolin N oxide isoquinolin-N-oxide isoquinoline-2-oxide isoquinoline-oxide 异喹啉 N-氧化物 异喹啉-N-氧化物 异喹啉-N-氧化物, MIN 50% W/V IN WATER
EC Number216-242-7
Beilstein Registry Number20(2)237
PubChem Substance ID290378
Chemical Name Translation异喹啉-N-氧化物
Reaxys-RN114345
InChIKeyRZIAABRFQASVSW-UHFFFAOYSA-N
LabNetwork Molecule IDLN00174171
InChIInChI=1S/C9H7NO/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H
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分类

  • {uni_hamburg} no charge; nitrogen heterocycle; carbocycle; aromatic; large ring; fused rings; 6ring; 10ring; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Isoquinolines

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

Warnings IRRITANT
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • 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；
Risk Statements
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
Storage condition Hygroscopic
WGK Germany3
GHS Symbol
UN Number
Hazard Codes
Signal word
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • 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
  • P305+P351+P338
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
RTECS
Packing Group
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛

其他信息

  • TCI Shanghai:异喹啉-N-氧化物 Isoquinoline N-Oxide,>;97.0%(T)(1532-72-5)
  • Sigma Aldrich:1532-72-5(sigmaaldrich)
  • 图谱信息:异喹啉-N-氧化物(1532-72-5)红外图谱(IR2) 异喹啉-N-氧化物(1532-72-5)核磁图( 13 CNMR) 异喹啉-N-氧化物(1532-72-5)质谱(MS) 异喹啉-N-氧化物(1532-72-5)核磁图( 1 HNMR) 异喹啉-N-氧化物(1532-72-5)红外图谱(IR1)
  • 上游原料:乙酸 --> 过氧化氢 --> 异喹啉
  • 异喹啉-N-氧化物价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 I0540 异喹啉N-氧化物 Isoquinoline N-Oxide 5G 584元 2014/06/02 I0540 异喹啉N-氧化物 Isoquinoline N-Oxide 25G 2020元 2010/05/25 A19738 异喹啉-N-氧化物, 98% Isoquinoline N-oxide, 98% 25g 2044元
  • Acros Organics:Isoquinoline-N-oxide, 94%(1532-72-5)
  • MOL 文件:1532-72-5.mol
  • 敏感性:Hygroscopic
  • Alfa Aesar:异喹啉-N-氧化物,min50%w/vinwater Isoquinoline N-oxide, min 50% w/v in water(1532-72-5)

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. Isoquinolines 异喹啉
  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. Isoquinolines 异喹啉
  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. Quinazolines 喹唑啉
  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. Quinolines 喹啉
  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. Quinoxalines 喹喔啉
  1. Functional Group 官能团索引
  2. N-oxide

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