Rac-(3aR,7aR)-5-[(tert-butoxy)carbonyl]-octahydro-1H-pyrrolo[3,4-c]pyridine-3a-carboxylic acid
Structure Info
- Chemspace ID
- CSSB20620684315 (In-Stock Building Blocks)
- CAS
- 2204313-36-8
- MFCD
- MFCD37450035
- IUPAC Name
- rac-(3aR,7aR)-5-[(tert-butoxy)carbonyl]-octahydro-1H-pyrrolo[3,4-c]pyridine-3a-carboxylic acid
- Mol formula
- C13H22N2O4
- Mol weight
- 270 Da
- Catalog Number(s)
- EN300-6491442, Z3377946918
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -2.1
- Heavy atoms count
- 19
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.846
- Polar surface area (Å)
- 79
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
![Chemical structure of Rac-(3aR,7aR)-5-[(tert-butoxy)carbonyl]-octahydro-1H-pyrrolo[3,4-c]pyridine-3a-carboxylic acid (C13H22N2O4) - CSSB20620684315](/st/structure/200/24e56c1b7deafc9ab5f90247abb26222/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540H%255D2CNC%255BC%2540%255D2%2528C1%2529C%2528O%2529%253DO%2B%257C%25261%253A10%252C14%252Cr%257C.png "C13H22N2O4")
- Zoom the structure
- CSSB20620684315
Items Overall 14 items from 2 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 275.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 410.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 586.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 925.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 1,185.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 2,324.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 3,438.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 5,099.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 275.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 410.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 586.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 925.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 1,185.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 2,324.00 |
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Substructure Analogs
![Chemical structure of rac-(3aR,7aS)-5-[(tert-butoxy)carbonyl]-2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-octahydro-1H-pyrrolo[3,4-c]pyridine-3a-carboxylic acid - CSSB21432469072](/st/structure/200/d405d0a2dc2e22be0d1f4f7711cba272/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540H%255D2CN%2528C%255BC%2540%255D2%2528C1%2529C%2528O%2529%253DO%2529C%2528%253DO%2529OCC1C2%253DC%2528C%253DCC%253DC2%2529C2%253DC1C%253DCC%253DC2%2B%257C%25261%253A10%252C14%252Cr%257C.png)