Ethyl (1r,4r)-1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate
Structure Info
- Chemspace ID
- CSSB06741646997 (In-Stock Building Blocks)
- CAS
- 2703782-31-2
- MFCD
- MFCD36945225
- IUPAC Name
- ethyl (1r,4r)-1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate
- Mol formula
- C12H19IO3
- Mol weight
- 338 Da
- Catalog Number(s)
- AR02AFC2, BBLS06741646997, BM44566, EN300-39870317, ST02AG3U, TX02AFSQ, bbls06741646997
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.91
- Heavy atoms count
- 16
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.916
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
![Chemical structure of Ethyl (1r,4r)-1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate (C12H19IO3) - CSSB06741646997](/st/structure/200/05c33b82b6656ee0e9d4116627b572de/CCOC%2528%253DO%2529%255BC%2540%255D1%2528C%255BC%2540%2540%255D2%2528CI%2529C1%2529C%2528O2%2529C%2528C%2529C.png "C12H19IO3")
- Zoom the structure
- CSSB06741646997
Items Overall 13 items from 2 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 623.70 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 798.60 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 1,118.70 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 1,731.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 2,203.30 | |
Description: ethyl 1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate; CAS: 2703782-31-2 | ||||||
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 493.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 644.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 920.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 1,449.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 1,857.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 3,641.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 5,387.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 7,988.00 | |
For a custom pack size or bulk
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Substructure Analogs
![Chemical structure of ethyl (1r,4r)-3-cyclopentyl-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB14813058878](/st/structure/200/84a7224428fd6e89cf46fbbed2a8244f/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C1CCCC1.png)
![Chemical structure of ethyl (1r,4r)-3-cyclohexyl-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB14813059140](/st/structure/200/253c7013316d77aef55381fec5f3f64c/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C1CCCCC1.png)
![Chemical structure of ethyl (1r,4r)-1-(iodomethyl)-3-(oxan-4-yl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB14813058630](/st/structure/200/730fc8e49209678cf084aa0d89b094ef/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C1CCOCC1.png)
![Chemical structure of ethyl (1r,4r)-3-cycloheptyl-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB14813058635](/st/structure/200/9327cbfdf426d2ee0f90a64b24a80a9a/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C1CCCCCC1.png)
![Chemical structure of ethyl (1r,4r)-3-cyclooctyl-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB14813058607](/st/structure/200/e975e43f50b269d4f34f832b227b2fc8/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C1CCCCCCC1.png)
![Chemical structure of tert-butyl 3-[(1r,4r)-4-(ethoxycarbonyl)-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexan-3-yl]azetidine-1-carboxylate - CSSB14813058685](/st/structure/200/55f1f58c763e69fda905a3b2f0e60456/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C1CN%2528C1%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of ethyl (1r,4r)-3-(diphenylmethyl)-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB14813058836](/st/structure/200/b3acb71f7b8a8001c88d56a82a9b7f71/CCOC%2528%253DO%2529%255BC%2540%255D12C%255BC%2540%255D%2528CI%2529%2528C1%2529OC2C%2528c1ccccc1%2529c1ccccc1.png)
Similarity Analogs
![Chemical structure of ethyl 1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB02138419208](/st/structure/200/bf38e8b52be64bbae5303feab212a27b/CCOC%2528%253DO%2529C12CC%2528CI%2529%2528C1%2529OC2C%2528C%2529C.png)
![Chemical structure of ethyl (1r,4r)-1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.2.2]octane-4-carboxylate - CSSB20620690665](/st/structure/200/94d54e3b4fbf575a77cb09d078c24c65/CCOC%2528%253DO%2529%255BC%2540%255D12CC%255BC%2540%255D%2528CI%2529%2528CC1%2529OC2C%2528C%2529C.png)
![Chemical structure of ethyl 1-(iodomethyl)-3-(propan-2-yl)-2-oxabicyclo[2.2.2]octane-4-carboxylate - CSSB06256046314](/st/structure/200/04c2c4883c1adc73c532e1ec22e0c7f3/CCOC%2528%253DO%2529C12CCC%2528CI%2529%2528CC1%2529OC2C%2528C%2529C.png)
![Chemical structure of ethyl 3-cyclohexyl-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB02209613797](/st/structure/200/48e7bc8d1a50da06495389dcba86db79/CCOC%2528%253DO%2529C12CC%2528CI%2529%2528C1%2529OC2C1CCCCC1.png)
![Chemical structure of ethyl 3-cycloheptyl-1-(iodomethyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylate - CSSB06256034135](/st/structure/200/ca013443f3b0aa77bfde5ddff4825add/CCOC%2528%253DO%2529C12CC%2528CI%2529%2528C1%2529OC2C1CCCCCC1.png)
