1,4-dimethyl bicyclo[2.2.2]octane-1,4-dicarboxylate
Structure Info
- Chemspace ID
- CSSB20620690347 (In-Stock Building Blocks)
- IUPAC Name
- 1,4-dimethyl bicyclo[2.2.2]octane-1,4-dicarboxylate
- Mol formula
- C12H18O4
- Mol weight
- 226 Da
- Catalog Number(s)
- BBLS20620690347, BBV-1550229899, EN300-52484217, PBMR1810073, bbls20620690347
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.05
- Heavy atoms count
- 16
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 53
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
![Chemical structure of 1,4-dimethyl bicyclo[2.2.2]octane-1,4-dicarboxylate (C12H18O4) - CSSB20620690347](/st/structure/200/ad39f575352fc7058eb8bca30021a653/COC%2528%253DO%2529%255BC%2540%255D12CC%255BC%2540%255D%2528CC1%2529%2528CC2%2529C%2528%253DO%2529OC.png "C12H18O4")
- Zoom the structure
- CSSB20620690347
Items Overall 11 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 19.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 19.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 19.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 19.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 19.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 26.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 38.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 75.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 25 g | 120.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 g | 239.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 g | 479.00 |
For a custom pack size or bulk
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Substructure Analogs
![Chemical structure of rac-1,4-diethyl (1R,4R)-2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate - CSSB20620690825](/st/structure/200/271b4e97a90878226b8f6bd6316a5663/CCOC%2528%253DO%2529%255BC%2540%2540%255D12CC%255BC%2540%255D%2528CC1%253DO%2529%2528C%2528%253DO%2529OCC%2529C%2528%253DO%2529C2%2B%257C%25261%253A5%252C8%252Cr%257C.png)
Similarity Analogs
![Chemical structure of 1,4-dimethyl bicyclo[2.2.2]octane-1,4-dicarboxylate - CSSB00000688976](/st/structure/200/8745dc6d7f334da9ad26781739bc2309/COC%2528%253DO%2529C12CCC%2528CC1%2529%2528CC2%2529C%2528%253DO%2529OC.png)
![Chemical structure of methyl 4-acetylbicyclo[2.2.2]octane-1-carboxylate - CSSB00021454657](/st/structure/200/46336a8b8e7c98a62f67465440387084/COC%2528%253DO%2529C12CCC%2528CC1%2529%2528CC2%2529C%2528C%2529%253DO.png)
![Chemical structure of 1,5-dimethyl bicyclo[3.2.2]nonane-1,5-dicarboxylate - CSSB00020625143](/st/structure/200/cbd4a44cf1ea16359692a0d1653e04c3/COC%2528%253DO%2529C12CCC%2528CC1%2529%2528CCC2%2529C%2528%253DO%2529OC.png)
![Chemical structure of 1,4-dimethyl bicyclo[2.2.1]heptane-1,4-dicarboxylate - CSSB00010605397](/st/structure/200/2e3ff20a6cb171390d92fdbfcb9153cd/COC%2528%253DO%2529C12CCC%2528CC1%2529%2528C2%2529C%2528%253DO%2529OC.png)
![Chemical structure of 1,4-dimethyl (1s,4s)-bicyclo[2.2.1]heptane-1,4-dicarboxylate - CSSB00135423279](/st/structure/200/b4e2fcee1b74091f72745bde275987ce/COC%2528%253DO%2529%255BC%2540%255D12CC%255BC%2540%255D%2528CC1%2529%2528C2%2529C%2528%253DO%2529OC.png)
![Chemical structure of 1,4-dimethyl (1r,4r)-bicyclo[2.2.1]heptane-1,4-dicarboxylate - CSSB14855344498](/st/structure/200/1940d6af4a3b7561f48ac27f907f5872/COC%2528%253DO%2529%255BC%2540%255D12CC%255BC%2540%2540%255D%2528CC1%2529%2528C2%2529C%2528%253DO%2529OC.png)
![Chemical structure of methyl 4-fluorobicyclo[2.2.2]octane-1-carboxylate - CSSB20620690953](/st/structure/200/441b3bff4bfdb1b4e6260d7adc85cfee/COC%2528%253DO%2529%255BC%2540%255D12CC%255BC%2540%255D%2528F%2529%2528CC1%2529CC2.png)
