1,3-dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate
Structure Info
- Chemspace ID
- CSSB03551561153 (In-Stock Building Blocks)
- CAS
- 115913-32-1
- IUPAC Name
- 1,3-dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate
- Mol formula
- C9H12O4
- Mol weight
- 184 Da
- Catalog Number(s)
- BBLS03551561153, BBV-392601407, EN300-37374003, bbls03551561153
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.72
- Heavy atoms count
- 13
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.777
- Polar surface area (Å)
- 53
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
![Chemical structure of 1,3-dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate (C9H12O4) - CSSB03551561153](/st/structure/200/84bba53166fd2e9ceb1cb502bc143ec7/COC%2528%253DO%2529%255BC%2540%255D1%2528C%255BC%2540%255D2%2528C1%2529C%2528%253DO%2529OC%2529C2.png "C9H12O4")
- Zoom the structure
- CSSB03551561153
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 | 21.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 26.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 29.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 36.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 42.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 85.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 158.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 281.00 |
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Substructure Analogs
![Chemical structure of 1-tert-butyl 3-methyl (1s,3s)-2-fluorobicyclo[1.1.1]pentane-1,3-dicarboxylate - CSSB07104938262](/st/structure/200/5f5cd2a1becb685596a47aa13a7cb16d/COC%2528%253DO%2529%255BC%2540%255D1%2528C%255BC%2540%255D2%2528C1%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C2F.png)
Similarity Analogs
![Chemical structure of 1,3-dimethyl bicyclo[1.1.1]pentane-1,3-dicarboxylate - CSSB00010392641](/st/structure/200/105e839d019de358a73d51d386c3d2d0/COC%2528%253DO%2529C12CC%2528C1%2529%2528C2%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 3-acetylbicyclo[1.1.1]pentane-1-carboxylate - CSSB00010641052](/st/structure/200/8bddfc20cba0671e4acdda0405c8e5d8/COC%2528%253DO%2529C12CC%2528C1%2529%2528C2%2529C%2528C%2529%253DO.png)
![Chemical structure of methyl 3-acetylbicyclo[1.1.1]pentane-1-carboxylate - CSSB20563214706](/st/structure/200/c495df6ccaa341ac8fc505a0eae1ed68/COC%2528%253DO%2529%255BC%2540%2540%255D12C%255BC%2540%2540%255D%2528C1%2529%2528C2%2529C%2528C%2529%253DO.png)
