Rac-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (3R,4R,6S)-5-oxotricyclo[2.2.1.0²,⁶]heptane-3-carboxylate
Structure Info
- Chemspace ID
- CSSB20620684907 (In-Stock Building Blocks)
- CAS
- 3095677-18-9
- IUPAC Name
- rac-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (3R,4R,6S)-5-oxotricyclo[2.2.1.0²,⁶]heptane-3-carboxylate
- Mol formula
- C16H11NO5
- Mol weight
- 297 Da
- Catalog Number(s)
- EN300-51746323
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.17
- Heavy atoms count
- 22
- Rotatable bond count
- 3
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 81
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
![Chemical structure of Rac-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (3R,4R,6S)-5-oxotricyclo[2.2.1.0²,⁶]heptane-3-carboxylate (C16H11NO5) - CSSB20620684907](/st/structure/200/67406ddcb965a779ec9f07b25965961b/O%253DC%2528ON1C%2528%253DO%2529C2%253DCC%253DCC%253DC2C1%253DO%2529%255BC%2540H%255D1C2C3C%255BC%2540%2540H%255D1C%2528%253DO%2529%255BC%2540%2540H%255D23%2B%257C%25261%253A14%252C18%252C21%252Cr%257C.png "C16H11NO5")
- Zoom the structure
- CSSB20620684907
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 | 563.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 591.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 618.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 645.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 671.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,315.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 1,945.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 2,884.00 |
For a custom pack size or bulk
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Substructure Analogs
![Chemical structure of rac-4,5,6,7-tetrachloro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (3R,4R,6S)-5-oxotricyclo[2.2.1.0²,⁶]heptane-3-carboxylate - CSSB21291556561](/st/structure/200/dfce90fbe839d55d35004c5bb3682820/ClC1%253DC%2528Cl%2529C%2528Cl%2529%253DC%2528Cl%2529C2%253DC1C%2528%253DO%2529N%2528OC%2528%253DO%2529%255BC%2540H%255D1C3C4C%255BC%2540%2540H%255D1C%2528%253DO%2529%255BC%2540%2540H%255D34%2529C2%253DO%2B%257C%25261%253A16%252C20%252C23%252Cr%257C.png)
Similarity Analogs
![Chemical structure of 1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl (1R,5S,6S)-3-oxabicyclo[3.1.0]hexane-6-carboxylate - CSSB00116211013](/st/structure/200/2c367921586516421764018a5451aff9/O%253DC%2528ON1C%2528%253DO%2529C2%253DCC%253DCC%253DC2C1%253DO%2529%255BC%2540%2540H%255D1%255BC%2540H%255D2COC%255BC%2540%2540H%255D12.png)
![Chemical structure of rac-2,5-dioxopyrrolidin-1-yl (3R,4R,6S)-5-oxotricyclo[2.2.1.0²,⁶]heptane-3-carboxylate - CSSB20620684963](/st/structure/200/7d365caeadaab67fff38b34cf256fb34/O%253DC%2528ON1C%2528%253DO%2529CCC1%253DO%2529%255BC%2540H%255D1C2C3C%255BC%2540%2540H%255D1C%2528%253DO%2529%255BC%2540%2540H%255D23%2B%257C%25261%253A10%252C14%252C17%252Cr%257C.png)
