Quinuclidine 奎宁环

CAS 100-76-5 MFCD00006690

化学结构图

100-76-5
SMILES: C1CN2CCC1CC2

化学属性

Mol. FormulaC7H13N
Mol. Weight111
Melting Point157-160°
Vapor Pressure1.5 mmHg ( 20 °C)
TSCAYes

别名和识别编码

Chemical NameQuinuclidine
MDL NumberMFCD00006690
CAS Number100-76-5
Synonym quinuclidine ABCO 1,4-ethylidinepiperidine 1-Aza-bicyclo[2.2.2]octane {uni_hamburg} 1,4-ethanopiperidine 1-AZABICYCLO[2.2.2]OCTANE 1-Azabicyclo[2.2.2]octan 奎宁环 1,4-Ethylenepiperidine 1-azonia-bicyclo[2.2.2]octane 1,4-亚乙基哌啶 1-azabicyclo[2.2.2]octane 【口+昆】啶 Chinuclidin 1,4-ETHYLENEPIPERIDINE 4-Azabicyclo[2.2.2]octane 1-Azabicyclo[2.2.2]octane QUINUCLIDINE
PubChem Substance ID7527
EC Number202-887-1
Beilstein Registry Number20(5)4,335
Merck Number8081
Chemical Name Translation奎宁环
Reaxys-RN103111
LabNetwork Molecule IDLN01739751
InChIInChI=1S/C7H13N/c1-4-8-5-2-7(1)3-6-8/h7H,1-6H2
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分类

  • {uni_hamburg} no charge; nitrogen heterocycle; alicycle; fused rings; 6RingOnly; 6ring; 1fragment
  • {SNA} Bioactive Small Molecules, Building Blocks, Cell Biology, Chemical Synthesis, Heterocyclic Building Blocks, Q, Quinuclidines

相关文献及参考

  • Short: II/19a Title: Molecular Constants: Rotational, l-type, Centrifugal Distortion and Related Constants of Diamagnetic Diatomic, Linear, and Symmetric Top Molecules Author: Demaison, J.; Hüttner, W.; Tiemann, E.; Wlodarczak, G. Editor: Hüttner, W. Source: Landolt-Börnstein, New Series Volume: II/19a Year: 1992 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-54409-7 ISBN: 978-3-540-54409-8 Internet Resource: DOI:10.1007/b42304 RefComment: XI, 143 pages. Abstract: Volume II/19 Molecular Constants mostly from Microwave, Molecular Beam and Sub-Doppler Laser Spectroscopy is a supplement to the earlier volumes II/4, II/6, and II/14. The slight change in the title reflects current trends in the applications of spectroscopic methods. Together, the four volumes collect all the critically evaluated data published up to 1989/90 on constants of free molecules obtained by classical and modern spectroscopy. Volume II/19 is divided into four parts to record the growing number of investigations, especially in the microwave and millimeter wave regions, where modern techniques like Fourier Transform Microwave Spectroscopy have made new objects of interest such as molecular complexes and clusters accessible to study. Subvolume II/19a contains a general introduction and tables of rotational and centrifugal distortion constants of diamagnetic, diatomic, linear and symmetric top molecules, which specify the frequences of the rotational transitions of these types of rotor.
  • Short: II/19c Title: Molecular Constants: Dipole Moments, Quadrupole Coupling Constants, Hindered Rotation and Magnetic Constants of Diamagnetic Molecules Author: Demaison, J.; Hüttner, W.; Tiemann, E.; Vogt, J.; Wlodarczak, G. Editor: Hüttner, W. Source: Landolt-Börnstein, New Series Volume: II/19c Year: 1992 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-54893-9 ISBN: 978-3-540-54893-5

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • H315 Causes skin irritation 会刺激皮肤
  • H310 Fatal in contact with skin 皮肤接触致命
  • H318 Causes serious eye damage 严重伤害眼睛
Personal Protective Equipment Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
RTECSCL5594625
Precautionary statements
  • 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。
  • P301+P310+P330
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P332+P313
  • P302+P352+P310+P361+P364
  • P405 Store locked up. 上锁保管。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛,皮肤或衣服。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
Signal word Danger
Hazard Codes T
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;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • S27 Take off immediately all contaminated clothing 立即脱掉全部污染的衣服;
  • S20 When using do not eat or drink 使用时,不得进食,饮水;
  • 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
  • R24/25 Toxic in contact with skin and if swallowed 皮肤接触及吞食都有毒
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
  • R38 Irritating to skin 刺激皮肤
UN Number 2811 UN 2811 6.1/PG 2 UN2811
Packing GroupII
Storage condition Air Sensitive
Hazard Class6.1

其他信息

  • 蒸气压:1.5 mm Hg ( 20 °C)
  • MOL 文件:100-76-5.mol
  • Sigma Aldrich:100-76-5(sigmaaldrich)
  • F:2-10

系列性分类


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