4-Cyanobenzophenone 4-氰基苯并苯基酮
CAS 1503-49-7 MFCD00016382
化学结构图
SMILES: N#Cc1ccc(C(=O)c2ccccc2)cc1
化学属性
| Mol. Formula | C14H9NO |
|---|---|
| Mol. Weight | 207.23 |
| Melting Point | 110-114 °C |
| TSCA | No |
| Boiling Point | 377°C at 760 mmHg |
别名和识别编码
| Chemical Name | 4-Cyanobenzophenone |
|---|---|
| Synonym | 4-Benzoylbenzonitrile {LY} 4-Benzoylbenzonitrile {} {LY} 4-Benzoylbenzonitrile {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Benzoylbenzonitrile {} {} {} {} {} {} {} {} |
| MDL Number | MFCD00016382 |
| CAS Number | 1503-49-7 |
| PubChem Substance ID | 73921 |
| EC Number | 216-126-6 |
| Beilstein Registry Number | 641181 |
| Chemical Name Translation | 4-氰基苯并苯基酮 |
| InChIKey | YSZWJJANSNFQMM-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00204154 |
| InChI | InChI=1S/C14H9NO/c15-10-11-6-8-13(9-7-11)14(16)12-4-2-1-3-5-12/h1-9H |
| Canonical SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C#N |
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分类
- {SNA} Building Blocks, C10 to C27, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks
- {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment
相关文献及参考
- Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who intend to use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H, subvolume III/35D contains the nucleus 13C, subvolume III/35E contains the nucleus 17O, and subvolume III/35G contains the nucleus 77Se. More nuclei will be presented later.
- 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.e
安全信息
GHS Symbol
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
- 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。
- P305+P351+P338
- H332 Harmful if inhaled 吸入有害
- H315 Causes skin irritation 会刺激皮肤
- H302 Harmful if swallowed 吞食有害
- H312 Harmful in contact with skin 皮肤接触有害
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- H319 Causes serious eye irritation 严重刺激眼睛
- 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 Wear suitable protective clothing 穿戴适当的防护服；
- S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
- R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
- R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
其他信息
- Sigma Aldrich:1503-49-7(sigmaaldrich)
- MOL 文件:1503-49-7.mol
- Alfa Aesar:4-氰基苯并苯基酮,98% 4-Cyanobenzophenone, 98%(1503-49-7)
- 4-氰基苯甲酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/06/21 346070050 4-氰基苯甲酮 4-Cyanobenzophenone 98% 5 GR 2378元 2010/06/21 346070010 4-氰基苯甲酮 4-Cyanobenzophenone 98% 1 GR 1035元 2010/05/25 A15764 4-氰基苯并苯基酮, 98% 4-Cyanobenzophenone, 98% 25g 9464元
- Acros Organics:4-Cyanobenzophenone, 98%(1503-49-7)
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