3-[(tert-butoxy)carbonyl]-5-chloro-6,6-difluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid
Structure Info
- Chemspace ID
- CSSB14898564029 (In-Stock Building Blocks)
- CAS
- 3059208-68-0
- IUPAC Name
- 3-[(tert-butoxy)carbonyl]-5-chloro-6,6-difluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid
- Mol formula
- C12H16ClF2NO4
- Mol weight
- 312 Da
- Catalog Number(s)
- BBV-1068400511, EN300-51995932
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.79
- Heavy atoms count
- 20
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.833
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of 3-[(tert-butoxy)carbonyl]-5-chloro-6,6-difluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid (C12H16ClF2NO4) - CSSB14898564029](/st/structure/200/28658e26e2d6b2bbaefba75c48165bb3/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528Cl%2529C%2528F%2529%2528F%2529CC2%2528C1%2529C%2528%253DO%2529O.png "C12H16ClF2NO4")
- Zoom the structure
- CSSB14898564029
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 | 226.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 337.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 481.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 758.00 | |
| 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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Substructure Analogs
![Chemical structure of rac-(1R,5S)-3-[(tert-butoxy)carbonyl]-5-chloro-6,6-difluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB14895577145](/st/structure/200/9851c87cbcba404277e3944257b9486b/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540%255D2%2528Cl%2529C%2528F%2529%2528F%2529C%255BC%2540%255D2%2528C1%2529C%2528%253DO%2529O%2B%257C%25261%253A9%252C15%252Cr%257C.png)
![Chemical structure of (1S,5R)-3-[(tert-butoxy)carbonyl]-5-chloro-6,6-difluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB20621195674](/st/structure/200/a4d3f3e4aa9da72d176fd993fd45a6be/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540%255D2%2528Cl%2529C%2528F%2529%2528F%2529C%255BC%2540%255D2%2528C1%2529C%2528O%2529%253DO.png)
Similarity Analogs
![Chemical structure of 3-[(tert-butoxy)carbonyl]-5,6,6-trifluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB14869063666](/st/structure/200/5db16c2a8dd952dd945a1da1f26918ac/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2%2528F%2529C%2528F%2529%2528F%2529CC2%2528C1%2529C%2528%253DO%2529O.png)
![Chemical structure of rac-(1R,5S)-3-[(tert-butoxy)carbonyl]-5,6,6-trifluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB14921843462](/st/structure/200/e460b21cc04088e2f59b989db113626d/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540%255D2%2528F%2529C%2528F%2529%2528F%2529C%255BC%2540%255D2%2528C1%2529C%2528%253DO%2529O%2B%257C%25261%253A9%252C15%252Cr%257C.png)
![Chemical structure of (1S,5R)-3-[(tert-butoxy)carbonyl]-5,6,6-trifluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB15301366649](/st/structure/200/25ed1ff2e5c5e07deb342bdf73e3b64d/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540%255D2%2528F%2529C%2528F%2529%2528F%2529C%255BC%2540%255D2%2528C1%2529C%2528O%2529%253DO.png)
![Chemical structure of rac-(1R,5S)-3-acetyl-5-chloro-6,6-difluoro-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB15082380358](/st/structure/200/4e8baa4fd10a4c9a2c86a87f6fded118/CC%2528%253DO%2529N1C%255BC%2540%2540%255D2%2528CC%2528F%2529%2528F%2529%255BC%2540%255D2%2528Cl%2529C1%2529C%2528O%2529%253DO%2B%257C%25261%253A5%252C10%252Cr%257C.png)
![Chemical structure of rac-(1R,5S)-5-chloro-6,6-difluoro-3-[(prop-2-en-1-yloxy)carbonyl]-3-azabicyclo[3.2.0]heptane-1-carboxylic acid - CSSB20620684490](/st/structure/200/6a3888c66c42c2953d10b351a7bc86e2/OC%2528%253DO%2529%255BC%2540%2540%255D12CC%2528F%2529%2528F%2529%255BC%2540%255D1%2528Cl%2529CN%2528C2%2529C%2528%253DO%2529OCC%253DC%2B%257C%25261%253A3%252C8%252Cr%257C.png)
