Ethyl 4-cyanobicyclo[2.2.2]octane-1-carboxylate
Structure Info
- Chemspace ID
- CSSB00020672544 (In-Stock Building Blocks)
- CAS
- 54829-94-6
- MFCD
- MFCD30528798, MFCD30528798
- IUPAC Name
- ethyl 4-cyanobicyclo[2.2.2]octane-1-carboxylate
- Mol formula
- C12H17NO2
- Mol weight
- 207 Da
- Catalog Number(s)
- A136264, A490015366, AG100913, BBLS00020672544, BBV-564939, BD00721862, CSC020672544, EN300-52238, FCH7377464, TX02B0GK, Y4022504, bbls00020672544, m_1458_25975584_483918, m_1458____25975584____483918
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.32
- Heavy atoms count
- 15
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 50
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
![Chemical structure of Ethyl 4-cyanobicyclo[2.2.2]octane-1-carboxylate (C12H17NO2) - CSSB00020672544](/st/structure/200/002159c417a16dcc659996f6ad9a1c3e/CCOC%2528%253DO%2529C12CCC%2528CC1%2529%2528CC2%2529C%2523N.png "C12H17NO2")
- Zoom the structure
- CSSB00020672544
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 | 815.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 855.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 894.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 932.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 971.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,903.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 2,816.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 4,176.00 |
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Similarity Analogs
![Chemical structure of ethyl 4-acetylbicyclo[2.2.2]octane-1-carboxylate - CSSB01957635813](/st/structure/200/a01ed042ccf2f29b4e6724d6547cd929/CCOC%2528%253DO%2529C12CCC%2528CC1%2529%2528CC2%2529C%2528C%2529%253DO.png)
![Chemical structure of methyl 4-cyanobicyclo[2.2.2]octane-1-carboxylate - CSSB00138565899](/st/structure/200/153074291ed813bd5ad65eec95960ba5/COC%2528%253DO%2529%255BC%2540%2540%255D12CC%255BC%2540%2540%255D%2528CC1%2529%2528CC2%2529C%2523N.png)
![Chemical structure of methyl 4-cyanobicyclo[2.2.2]octane-1-carboxylate - CSSB00010750477](/st/structure/200/ddc06dca9985e2af157ce9868995f1b1/COC%2528%253DO%2529C12CCC%2528CC1%2529%2528CC2%2529C%2523N.png)
