113520-28-8
113520-28-8 structure
- Name: 2-[3-(2-ethoxy-2-oxoethyl)phenyl]acetate
- Chemical Name: 2-[3-(2-ethoxy-2-oxoethyl)phenyl]acetate
- CAS Number: 113520-28-8
- Molecular Formula: C12H13O4
- Molecular Weight: 221.22900
- Create Date: 2016-04-24 23:33:35
- Modify Date: 2024-01-10 06:05:42
| Name | 2-[3-(2-ethoxy-2-oxoethyl)phenyl]acetate |
|---|---|
| Synonyms |
1,3-benzenediacetic acid monoethyl ester
1,3-benzenediacetic acid 1-ethyl ester [3-(2-oxo-propyl)-phenyl]-acetic acid ethyl ester [3-(2-ethoxy-2-oxoethyl)phenyl]acetic acid (3-ethoxycarbonylmethylphenyl)acetic acid |
| Molecular Formula | C12H13O4 |
|---|---|
| Molecular Weight | 221.22900 |
| Exact Mass | 221.08100 |
| PSA | 66.43000 |
| LogP | 0.08460 |
|
~73%
113520-28-8 |
| Literature: De Koning, Pieter D.; Gladwell, Iain R.; Morrison, Natalie A.; Moses, Ian B.; Panesar, Maninder S.; Pettman, Alan J.; Thomson, Nicholas M.; Yazbeck, Daniel R. Organic Process Research and Development, 2011 , vol. 15, # 4 p. 871 - 875 |
|
~74%
113520-28-8 |
| Literature: PFIZER LIMITED Patent: WO2007/10356 A2, 2007 ; Location in patent: Page/Page column 22 ; |
|
~26%
113520-28-8 |
| Literature: Glossop, Paul A.; Lane, Charlotte A. L.; Price, David A.; Bunnage, Mark E.; Lewthwaite, Russell A.; James, Kim; Brown, Alan D.; Yeadon, Michael; Perros-Huguet, Christelle; Trevethick, Michael A.; Clarke, Nicholas P.; Webster, Robert; Jones, Rhys M.; Burrows, Jane L.; Feeder, Neil; Taylor, Stefan C. J.; Spence, Fiona J. Journal of Medicinal Chemistry, 2010 , vol. 53, # 18 p. 6640 - 6652 |
|
~%
113520-28-8 |
| Literature: Brown, Alan Daniel; James, Kim; Lane, Charlotte Alice Louise; Moses, Ian Brian; Thomson, Nicholas Murray Patent: US2005/171147 A1, 2005 ; Location in patent: Page/Page column 21 ; |
|
~39%
113520-28-8 |
| Literature: De Koning, Pieter D.; Gladwell, Iain R.; Morrison, Natalie A.; Moses, Ian B.; Panesar, Maninder S.; Pettman, Alan J.; Thomson, Nicholas M.; Yazbeck, Daniel R. Organic Process Research and Development, 2011 , vol. 15, # 4 p. 871 - 875 |
|
~%
113520-28-8 |
| Literature: De Koning, Pieter D.; Gladwell, Iain R.; Morrison, Natalie A.; Moses, Ian B.; Panesar, Maninder S.; Pettman, Alan J.; Thomson, Nicholas M.; Yazbeck, Daniel R. Organic Process Research and Development, 2011 , vol. 15, # 4 p. 871 - 875 |
|
~%
113520-28-8 |
| Literature: PFIZER LIMITED; DUPONT, Thomas Pierre; FEDOU, Nicolas Mickaël; SMITH, Julian Duncan; TWIDDLE, Steven John Robert Patent: WO2013/21309 A1, 2013 ; |
| Precursor 5 | |
|---|---|
| DownStream 1 | |
![2-[3-(2-hydroxy-2-methylpropyl)phenyl]acetic acid structure](https://www.chemsrc.com/caspic/201/808768-96-9.png)