Spiro(2,4)hepta-4,6-diene 螺[2.4]庚-4,6-二烯
CAS 765-46-8 MFCD00013274
化学结构图
SMILES: C1=CC2(C=C1)CC2
化学属性
| Mol. Formula | C7H8 |
|---|---|
| Mol. Weight | 92.14 |
| Density | 0.92 g/mL at 20 °C(lit.) |
| Boiling Point | 113 °C at 737 mmHg |
别名和识别编码
| Chemical Name | Spiro(2,4)hepta-4,6-diene |
|---|---|
| Synonym | Spiro[2.4]hepta-4,6-diene {LY} Spiro[2.4]hepta-4,6-diene {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Spiro[2.4]hepta-4,6-diene {} {} {} {} {} {} {} {} {} {} {} {} {} |
| CAS Number | 765-46-8 |
| MDL Number | MFCD00013274 |
| PubChem Substance ID | 136590 |
| Beilstein Registry Number | 969332 |
| Chemical Name Translation | 螺[2.4]庚-4,6-二烯 |
| InChIKey | KPDOKSJMJMDRQA-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00200890 |
| InChI | InChI=1S/C7H8/c1-2-4-7(3-1)5-6-7/h1-4H,5-6H2 |
| Canonical SMILES | C1=CC2(C=C1)CC2 |
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分类
- {SNA} Alkenes, Building Blocks, Chemical Synthesis, Cyclic, Organic Building Blocks
- {uni_hamburg} no charge; carbocycle; alicycle; fused rings; 3ring; 5ring; spiro; 1fragment
相关文献及参考
- Short: II/14a Title: Molecular Constants: Diamagnetic Molecules Author: Demaison, J.; Dubrulle, A.; Hüttner, W.; Tiemann, E. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: II/14a Page: 1-788 Year: 1982 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-11365-7 ISBN: 978-3-540-11365-2 Internet Resource: DOI:10.1007/b19966 RefComment: 196 figs., XI
- Short: II/19b Title: Molecular Constants: Rotational, Centrifugal Distortion and Related Constants of Diamagnetic Asymmetric Top Molecules Author: Demaison, J.; Hüttner, W.; Vogt, J.; Wlodarczak, G. Editor: Hüttner, W. Source: Landolt-Börnstein, New Series Volume: II/19b Year: 1992 Keyword: organic compounds; molecular constants; spectroscopy; microwave spectroscopy ISBN: 3-540-54578-6 ISBN: 978-3-540-54578-1 Internet Resource: DOI:10.1007/b44334 RefComment: XI, 488 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/19b contains corresponding data on diamagnetic asymmetric top molecules.
- Short: II/25D Title: Structure Data of Free Polyatomic Molecules: Molecules Containing Five or More Carbon Atoms Author: Graner, G.; Hirota, E.; Iijima, T.; Kuchitsu, K.; Ramsay, D.A.; Vogt, J.;
安全信息
GHS Symbol
- H315 Causes skin irritation 会刺激皮肤
- H304 May be fatal if swallowed and enters airways 吞食和进入呼吸道可能致命
- H301 Toxic if swallowed 吞食有毒
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- H350 May cause cancer 可能致癌
- H319 Causes serious eye irritation 严重刺激眼睛
- H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- P301+P310
- P308+P313
- P305+P351+P338
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P201 Obtain special instructions before use. 使用前获取专门指示。
- R11 Highly flammable 非常易燃
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- R45 May cause cancer 可能致癌
- R65 Harmful: may cause lung damage if swallowed 若吞咽可能伤害肺部器官
- 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；
- 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）；
- S62 If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label where possible 吞食后不要催吐：立即求医并出示该容器或标签；
- S53 Avoid exposure - obtain special instructions before use 避免接触，使用前获得特别指示说明；
- S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
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