Tert-butyl (4aS,7aR)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate hydrochloride
Structure Info
- Chemspace ID
- CSSB00025716601 (In-Stock Building Blocks)
- MFCD
- MFCD28896648, MFCD28892915
- IUPAC Name
- tert-butyl (4aS,7aR)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate hydrochloride
- Mol formula
- C11H21ClN2O3
- Mol weight
- 265 Da
- Catalog Number(s)
- ABC00302017, AG032LB5, AKOS027337348, AS-54997, ArZ-UP367060, BBLS00025716601, BD00933459, BD00951103, BD446229, BD757507, CD11373200, CS-0039921, CSC025716601, IDD06889, LN01331578, TX032MGT, W11394, W11394-0.25G, W12000, W12000-0.25G, WXC02017, Y1106078, Y6164173, ZXC140196, bbls00025716601
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.46
- Heavy atoms count
- 17
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.909
- Polar surface area (Å)
- 51
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of Tert-butyl (4aS,7aR)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate hydrochloride (C11H21ClN2O3) - CSSB00025716601](/st/structure/200/642904dad084b2f71f950518c876fd1e/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540H%255D2NCCO%255BC%2540%2540H%255D2C1.png "C11H21ClN2O3")
- Zoom the structure
- CSSB00025716601
Items Overall 4 items from 2 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Astatech Inc | 2 days | United States To: | 95 | 250 mg | 327.80 | |
| Astatech Inc | 2 days | United States To: | 95 | 1 g | 768.90 | |
Description: CIS-TERT-BUTYL HEXAHYDROPYRROLO[3,4-B][1,4]OXAZINE-6(2H)-CARBOXYLATE HCL; CAS: 1958068-89-7 | ||||||
| eNovation CN | 20 days | China To: | 95 | 250 mg | 379.50 | |
| eNovation CN | 20 days | China To: | 95 | 1 g | 891.25 | |
Description: CIS-TERT-BUTYL HEXAHYDROPYRROLO[3,4-B][1,4]OXAZINE-6(2H)-CARBOXYLATE HCL; CAS: 1958068-89-7 | ||||||
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Substructure Analogs
![Chemical structure of rac-tert-butyl (4aR,7aS)-4-(carbonochloridoyl)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB21291564568](/st/structure/200/c54cb08a5544f793603b436a5e3556af/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2OCCN%2528%255BC%2540H%255D2C1%2529C%2528Cl%2529%253DO%2B%257C%25261%253A9%252C14%252Cr%257C.png)
![Chemical structure of rac-tert-butyl (4aR,7aS)-4-(chlorosulfonyl)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB21291563633](/st/structure/200/31bf6a6c3af81c73283f4cb081247b79/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2OCCN%2528%255BC%2540H%255D2C1%2529S%2528Cl%2529%2528%253DO%2529%253DO%2B%257C%25261%253A9%252C14%252Cr%257C.png)
![Chemical structure of rac-tert-butyl (4aR,7aS)-4-(4,6-dichloro-1,3,5-triazin-2-yl)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB21282193391](/st/structure/200/6ddcc3c5d818ffa73ef73675f4e28c10/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2OCCN%2528%255BC%2540H%255D2C1%2529C1%253DNC%2528Cl%2529%253DNC%2528Cl%2529%253DN1%2B%257C%25261%253A9%252C14%252Cr%257C.png)
Similarity Analogs
![Chemical structure of tert-butyl (4aR,7aR)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate hydrochloride - CSSB02515423612](/st/structure/200/9c98e65b902b44e712f58b5aeeb46c94/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2NCCO%255BC%2540%2540H%255D2C1.png)
![Chemical structure of tert-butyl (4aR,7aS)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate hydrochloride - CSSB00132310268](/st/structure/200/fba6119fee7cd2255213d0a01a5edf1b/Cl.CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2NCCO%255BC%2540H%255D2C1.png)
![Chemical structure of tert-butyl octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB00000688211](/st/structure/200/8957b36e01b9fd2761cbf71ba76b1f37/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CC2NCCOC2C1.png)
![Chemical structure of rac-tert-butyl (4aR,7aR)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB00040555579](/st/structure/200/61b323e76f31bdaf39e2fa449b5e581c/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540H%255D2NCCO%255BC%2540H%255D2C1%2B%257C%25261%253A9%252C14%252Cr%257C.png)
![Chemical structure of tert-butyl (4aS,7aS)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB00016150873](/st/structure/200/f002c31edeaf1341062d39a88e879f91/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540%2540H%255D2NCCO%255BC%2540H%255D2C1.png)
![Chemical structure of rac-tert-butyl (4aR,7aS)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB20620684477](/st/structure/200/d03087237c29395d76880d35aad0be41/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2NCCO%255BC%2540H%255D2C1%2B%257C%25261%253A9%252C14%252Cr%257C.png)
![Chemical structure of tert-butyl (4aR,7aR)-octahydropyrrolo[3,4-b][1,4]oxazine-6-carboxylate - CSSB00010062940](/st/structure/200/e7ada863cccab517839db6bb0c63709e/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%255BC%2540H%255D2NCCO%255BC%2540%2540H%255D2C1.png)
