4,4-Diphenylbutan-2-one 4,4-二苯基丁酮
CAS 5409-60-9 MFCD00017619
化学结构图
SMILES: CC(=O)CC(c1ccccc1)c1ccccc1
化学属性
| Mol. Formula | C16H16O |
|---|---|
| Mol. Weight | 224.30 |
| TSCA | No |
| Melting Point | 170-171 °C |
| Boiling Point | 164.5-168 °C at 4-5 mmHg |
别名和识别编码
| Chemical Name | 4,4-Diphenylbutan-2-one |
|---|---|
| Synonym | 4,4-Diphenylbutan-2-one {LY} 4,4-Diphenylbutan-2-one {} {LY} 4,4-Diphenylbutan-2-one {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4,4-Diphenylbutan-2-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { |
| MDL Number | MFCD00017619 |
| CAS Number | 5409-60-9 |
| EC Number | 226-482-4 |
| Chemical Name Translation | 4,4-二苯基丁酮 |
| InChIKey | FPHXYKLKNOEKTQ-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN02141338 |
| PubChem Substance ID | 79421 |
| InChI | InChI=1S/C16H16O/c1-13(17)12-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,12H2,1H3 |
| Canonical SMILES | CC(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2 |
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分类
- {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment
- {SNA} Building Blocks, C15 to C38, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
相关文献及参考
- 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
- Short: III/35C1 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Hydrogen-1, Part 1: Aliphatic and Aromatic Hydrocarbons, Steroids, Carbohydrates Author: Gupta, R.R.; Jain, M. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35C1 Year: 2000 ISBN: 3-540-66780-6 ISBN: 978-3-540-66780-3 Internet Resource: DOI:10.1007/b60149 RefComment: VII, 310 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), and carbon-13 (subvol. D) 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.
安全信息
GHS Symbol
- R22 Harmful if swallowed 吞咽有害
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