Rac-tert-butyl (3aR,7aR)-7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride
Structure Info
- Chemspace ID
- CSSB20620684126 (In-Stock Building Blocks)
- CAS
- 3026598-74-0
- MFCD
- MFCD35252998
- IUPAC Name
- rac-tert-butyl (3aR,7aR)-7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride
- Mol formula
- C14H28ClN2O3P
- Mol weight
- 339 Da
- Catalog Number(s)
- EN300-46737496
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -1.5
- Heavy atoms count
- 21
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.928
- Polar surface area (Å)
- 59
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of Rac-tert-butyl (3aR,7aR)-7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride (C14H28ClN2O3P) - CSSB20620684126](/st/structure/200/00cf4de9f40fb5727603178826579a17/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%255D2%2528CNC%255BC%2540H%255D2C1%2529P%2528C%2529%2528C%2529%253DO%2B%257C%25261%253A11%252C15%252Cr%257C.png "C14H28ClN2O3P")
- Zoom the structure
- CSSB20620684126
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 | 232.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 347.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 494.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 780.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 999.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,959.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 2,899.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 4,299.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 232.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 347.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 494.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 780.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 999.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,959.00 |
For a custom pack size or bulk
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Substructure Analogs
![Chemical structure of tert-butyl (3aS,7aS)-7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride - CSSB20621799982](/st/structure/200/857c40694e77427156dcedbe9cc18dba/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%255D2%2528CNC%255BC%2540H%255D2C1%2529P%2528C%2529%2528C%2529%253DO.png)
![Chemical structure of rac-tert-butyl (3aR,7aS)-2-(carbonochloridoyl)-7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate - CSSB21291564422](/st/structure/200/c3cef6f13c4fd9e40cb7074910d5c97d/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%255D2%2528CN%2528C%255BC%2540H%255D2C1%2529C%2528Cl%2529%253DO%2529P%2528C%2529%2528C%2529%253DO%2B%257C%25261%253A10%252C14%252Cr%257C.png)
![Chemical structure of rac-tert-butyl (3aR,7aS)-2-(chlorosulfonyl)-7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate - CSSB21291564420](/st/structure/200/0778fc0942e88aa6a2c2962d8970f8d3/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%255D2%2528CN%2528C%255BC%2540H%255D2C1%2529S%2528Cl%2529%2528%253DO%2529%253DO%2529P%2528C%2529%2528C%2529%253DO%2B%257C%25261%253A10%252C14%252Cr%257C.png)
Similarity Analogs
![Chemical structure of tert-butyl 7a-(dimethylphosphoryl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride - CSSB20504684418](/st/structure/200/928ca340fdbf3e04201c01514f33d0ec/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%2528CNCC2C1%2529P%2528C%2529%2528C%2529%253DO.png)
![Chemical structure of tert-butyl 7a-(hydroxymethyl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate - CSSB03496549398](/st/structure/200/3f5344c1cbe7d40cb0f994c3870bf11a/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%2528CO%2529CNCC2C1.png)
![Chemical structure of 5-tert-butyl 7a-methyl octahydro-1H-pyrrolo[3,4-c]pyridine-5,7a-dicarboxylate - CSSB02127025285](/st/structure/200/02be453652a45f427c687998e126ecdb/COC%2528%253DO%2529C12CNCC1CN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of tert-butyl 4-(hydroxymethyl)-2,8-diazaspiro[4.5]decane-8-carboxylate - CSSB00010366084](/st/structure/200/1dbb0bbad92b563e3a9b6c7194baeddc/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%2528CNCC2CO%2529CC1.png)
![Chemical structure of tert-butyl 7a-(trifluoromethyl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride - CSSB21043405918](/st/structure/200/e24768d9d1292bb8148b25657c043f12/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%2528CNCC2C1%2529C%2528F%2529%2528F%2529F.png)
![Chemical structure of rac-tert-butyl (3aR,7aR)-7a-(trifluoromethyl)-octahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate hydrochloride - CSSB20621780750](/st/structure/200/36168cff35ac13009ad45a07cbd3f3c7/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%255D2%2528CNC%255BC%2540H%255D2C1%2529C%2528F%2529%2528F%2529F%2B%257C%25261%253A11%252C15%252Cr%257C.png)
