55696-50-9
55696-50-9 structure
- Name: tert-butyl 4-cyanobenzoate
- Chemical Name: tert-butyl 4-cyanobenzoate
- CAS Number: 55696-50-9
- Molecular Formula: C12H13NO2
- Molecular Weight: 203.23700
- Create Date: 2016-07-13 16:43:10
- Modify Date: 2025-08-26 20:49:28
| Name | tert-butyl 4-cyanobenzoate |
|---|---|
| Synonyms |
4-cyanobenzoic acid 1,1-dimethylethyl ester
p-(t-BuO2C)C6H4CN 4-cyano-benzoic acid tert-butyl ester tert-butyl p-cyanobenzoate 4-cyanobenzoic acid t-butyl ester |
| Density | 1.09g/cm3 |
|---|---|
| Boiling Point | 315.5ºC at 760 mmHg |
| Molecular Formula | C12H13NO2 |
| Molecular Weight | 203.23700 |
| Flash Point | 147.3ºC |
| Exact Mass | 203.09500 |
| PSA | 50.09000 |
| LogP | 2.51358 |
| Index of Refraction | 1.518 |
| HS Code | 2926909090 |
|---|
|
~42%
55696-50-9 |
| Literature: AQUILUS PHARMACEUTICALS, INC.; SUCHOLEIKI, Irving Patent: WO2014/62204 A1, 2014 ; Location in patent: Page/Page column 54-55 ; |
|
~%
55696-50-9 |
| Literature: Takeda Chemical Industries, Ltd. Patent: US5876756 A1, 1999 ; |
|
~51%
55696-50-9 |
| Literature: Wu, Yusheng; Li, Xinjian; Zou, Dapeng; Zhu, Helong; Wang, Yaping; Li, Jingya; Wu, Yangjie Organic Letters, 2014 , vol. 16, # 7 p. 1836 - 1839 |
|
~97%
55696-50-9 |
| Literature: Nasim, Shama; Guzman, Monica L.; Jordan, Craig T.; Crooks, Peter A. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 16 p. 4879 - 4883 |
|
~55%
55696-50-9 |
| Literature: Wu, Yusheng; Li, Xinjian; Zou, Dapeng; Zhu, Helong; Wang, Yaping; Li, Jingya; Wu, Yangjie Organic Letters, 2014 , vol. 16, # 7 p. 1836 - 1839 |
|
~%
55696-50-9 |
| Literature: Antonello, Sabrina; Maran, Flavio Journal of the American Chemical Society, 1997 , vol. 119, # 51 p. 12595 - 12600 |
|
~%
55696-50-9 |
| Literature: Frizler, Maxim; Lohr, Friederike; Furtmann, Norbert; Klaes, Julia; Guetschow, Michael Journal of Medicinal Chemistry, 2011 , vol. 54, # 1 p. 396 - 400 |
|
~%
55696-50-9 |
| Literature: Stanton, Matthew G. Journal of the American Chemical Society, 1998 , vol. 120, # 24 p. 5981 - 5989 |
| Precursor 10 | |
|---|---|
| DownStream 1 | |
| HS Code | 2926909090 |
|---|---|
| Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |