Tert-butyl 2-oxo-octahydro-1H-pyrrolo[3,2-c]pyridine-5-carboxylate
Structure Info
- Chemspace ID
- CSSB00010203947 (In-Stock Building Blocks)
- CAS
- 1221818-92-3
- MFCD
- MFCD16039669, MFCD16039669
- IUPAC Name
- tert-butyl 2-oxo-octahydro-1H-pyrrolo[3,2-c]pyridine-5-carboxylate
- Mol formula
- C12H20N2O3
- Mol weight
- 240 Da
- Catalog Number(s)
- 0955AP, 1279AP, AKOS023567620, BBLS00010203947, BBV-45002906, CSC010203947, EN300-1266550, FCH1626684, PBW0936, bbls00010203947
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.05
- Heavy atoms count
- 17
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 59
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
![Chemical structure of Tert-butyl 2-oxo-octahydro-1H-pyrrolo[3,2-c]pyridine-5-carboxylate (C12H20N2O3) - CSSB00010203947](/st/structure/200/e71959307e42679998be4ada33a0f626/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2NC%2528%253DO%2529CC2C1.png "C12H20N2O3")
- Zoom the structure
- CSSB00010203947
Items Overall 7 items from 2 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 5 days | United States To: | 95 | 50 umol | 205.29 | |
| BB4LS US | 5 days | United States To: | 95 | 100 umol | 209.09 | |
| BB4LS US | 5 days | United States To: | 95 | 200 umol | 212.89 | |
| BB4LS US | 5 days | United States To: | 95 | 300 umol | 216.69 | |
| BB4LS US | 5 days | United States To: | 95 | 500 umol | 220.49 | |
| AK Scientific Inc. | 5 days | United States To: | 95 | 1 g | 211.20 | |
| AK Scientific Inc. | 5 days | United States To: | 95 | 5 g | 795.30 | |
Description: 2-Thioxo-octhydro-pyrrolo[3,2-c]pyridine-5-carboxylic acid tert-butyl ester | ||||||
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Substructure Analogs
![Chemical structure of rac-(3aR,7aR)-5-[(tert-butoxy)carbonyl]-2-oxo-octahydro-1H-pyrrolo[3,2-c]pyridine-3a-carboxylic acid - CSSB20620686464](/st/structure/200/963638b7a3a6eeee8255f0fad773b229/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540H%255D2NC%2528%253DO%2529C%255BC%2540%255D2%2528C1%2529C%2528O%2529%253DO%2B%257C%25261%253A10%252C15%252Cr%257C.png)
![Chemical structure of 5-[(tert-butoxy)carbonyl]-2-oxo-octahydro-1H-pyrrolo[3,2-c]pyridine-3a-carboxylic acid - CSSB00044494094](/st/structure/200/cf816878d688d460ea3ef23517325218/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2NC%2528%253DO%2529CC2%2528C1%2529C%2528O%2529%253DO.png)
![Chemical structure of (3aR,7aR)-5-[(tert-butoxy)carbonyl]-2-oxo-octahydro-1H-pyrrolo[3,2-c]pyridine-3a-carboxylic acid - CSSB20621800213](/st/structure/200/5af4104f944a6f1ee8da7e369549befc/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540H%255D2NC%2528%253DO%2529C%255BC%2540%255D2%2528C1%2529C%2528O%2529%253DO.png)
Similarity Analogs
![Chemical structure of tert-butyl 4-oxo-[2,3'-biazetidine]-1'-carboxylate - CSSB00137590722](/st/structure/200/6583cd0ddfd5b32aaf4170370af53351/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%2528C1%2529C1CC%2528%253DO%2529N1.png)
![Chemical structure of rac-tert-butyl (4aR,8aR)-2-oxo-octahydro-1H-pyrido[3,4-b][1,4]oxazine-6-carboxylate - CSSB20680306324](/st/structure/200/9a270bdef8b64e42ab418ddb46d5e6b6/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%2540H%255D2NC%2528%253DO%2529CO%255BC%2540H%255D2C1%2B%257C%25261%253A10%252C16%252Cr%257C.png)
![Chemical structure of tert-butyl (4aR,8aS)-3-oxo-octahydro-2H-pyrido[4,3-b][1,4]oxazine-6-carboxylate - CSSB01916198827](/st/structure/200/79627af7be8d3adea8a940eecfeb3ff1/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC%255BC%2540%2540H%255D2OCC%2528%253DO%2529N%255BC%2540%2540H%255D2C1.png)
