3-{[1-(2,2,2-trifluoroacetyl)pyrrolidin-3-yl]oxy}benzoic acid
Structure Info
- Chemspace ID
- CSSB03496564030 (In-Stock Building Blocks)
- CAS
- 2680787-84-0
- MFCD
- MFCD36926095
- IUPAC Name
- 3-{[1-(2,2,2-trifluoroacetyl)pyrrolidin-3-yl]oxy}benzoic acid
- Mol formula
- C13H12F3NO4
- Mol weight
- 303 Da
- Catalog Number(s)
- BBLS03496564030, BBV-391748859, EN300-28290834, TX02BF1F, bbls03496564030
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.8
- Heavy atoms count
- 21
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.384
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
![Chemical structure of 3-{[1-(2,2,2-trifluoroacetyl)pyrrolidin-3-yl]oxy}benzoic acid (C13H12F3NO4) - CSSB03496564030](/st/structure/200/67ac6a75792355764f68b25c8ddaf19e/OC%2528%253DO%2529C1%253DCC%253DCC%2528OC2CCN%2528C2%2529C%2528%253DO%2529C%2528F%2529%2528F%2529F%2529%253DC1.png "C13H12F3NO4")
- Zoom the structure
- CSSB03496564030
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 912.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 955.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 999.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 1,042.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 1,086.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 2,127.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 3,147.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 4,667.00 |
For a custom pack size or bulk
please drop us a line:Enquire
please drop us a line:Enquire
Similarity Analogs
![Chemical structure of 3-{[1-(2,2,2-trifluoroacetyl)azetidin-3-yl]oxy}benzoic acid - CSSB03496561696](/st/structure/200/3dd4ae6e0c91eb0ce8531e5488edb49e/OC%2528%253DO%2529C1%253DCC%253DCC%2528OC2CN%2528C2%2529C%2528%253DO%2529C%2528F%2529%2528F%2529F%2529%253DC1.png)
![Chemical structure of 4-{[1-(2,2,2-trifluoroacetyl)pyrrolidin-3-yl]oxy}benzoic acid - CSSB06640341477](/st/structure/200/0d2cffb53e18d602675d318bfa53bcbc/OC%2528%253DO%2529c1ccc%2528OC2CCN%2528C2%2529C%2528%253DO%2529C%2528F%2529%2528F%2529F%2529cc1.png)
![Chemical structure of 3-({1-[(tert-butoxy)carbonyl]pyrrolidin-3-yl}oxy)benzoic acid - CSSB00010139773](/st/structure/200/97794d96884b2a5646669441f516a308/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC%2528C1%2529OC1%253DCC%253DCC%2528%253DC1%2529C%2528O%2529%253DO.png)
![Chemical structure of 3-{[(3S)-1-[(tert-butoxy)carbonyl]pyrrolidin-3-yl]oxy}benzoic acid - CSSB00040479300](/st/structure/200/9e1e1ab2a33012cee073413d86610104/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%2540H%255D%2528C1%2529OC1%253DCC%253DCC%2528%253DC1%2529C%2528O%2529%253DO.png)
![Chemical structure of 3-{[(3R)-1-[(tert-butoxy)carbonyl]pyrrolidin-3-yl]oxy}benzoic acid - CSSB00102564795](/st/structure/200/676ec607e0addeea779cb8c149f7f66e/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540H%255D%2528C1%2529OC1%253DCC%253DCC%2528%253DC1%2529C%2528O%2529%253DO.png)
![Chemical structure of 3-[1-(2,2,2-trifluoroacetyl)pyrrolidin-3-yl]benzoic acid - CSSB03496561375](/st/structure/200/c0431ed9d8dda830053c24d3c98ba657/OC%2528%253DO%2529C1%253DCC%253DCC%2528%253DC1%2529C1CCN%2528C1%2529C%2528%253DO%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of 4-{[1-(2,2,2-trifluoroacetyl)piperidin-4-yl]oxy}benzoic acid - CSSB03496565943](/st/structure/200/353dc6d9401e6d1fc8dc7b6d8b47d9c4/OC%2528%253DO%2529C1%253DCC%253DC%2528OC2CCN%2528CC2%2529C%2528%253DO%2529C%2528F%2529%2528F%2529F%2529C%253DC1.png)
