Tert-butyl 5-bromo-6-methoxy-1,2,3,4-tetrahydroisoquinoline-2-carboxylate
Structure Info
- Chemspace ID
- CSSB02448608401 (In-Stock Building Blocks)
- CAS
- 2680801-97-0
- MFCD
- MFCD35250833, MFCD35250833
- IUPAC Name
- tert-butyl 5-bromo-6-methoxy-1,2,3,4-tetrahydroisoquinoline-2-carboxylate
- Mol formula
- C15H20BrNO3
- Mol weight
- 342 Da
- Catalog Number(s)
- BBLS02448608401, BBV-391738870, BD02820587, EN300-28297349, JS61991, PV-002802994467, TX0F1HL7, Z5025057566, ZX-NM309221, bbls02448608401, m282070____22237244____26287130, s_282070____22237244____26287130
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.47
- Heavy atoms count
- 20
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.533
- Polar surface area (Å)
- 39
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB02448608401
Items Overall 24 items from 4 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 100.62 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 139.92 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 199.00 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 243.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 303.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 162.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 241.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 347.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 546.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 699.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,370.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 2,028.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 3,007.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 162.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 241.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 347.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 546.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 699.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,370.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 100.62 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 139.92 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 199.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 243.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 303.00 |
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Substructure Analogs
![Chemical structure of 2-({5-bromo-2-[(tert-butoxy)carbonyl]-1,2,3,4-tetrahydroisoquinolin-6-yl}oxy)acetic acid - CSSB21142021850](/st/structure/200/6bea9cb5f5d9fdd09f090f1a1593e647/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%253DC%2528C1%2529C%253DCC%2528OCC%2528O%2529%253DO%2529%253DC2Br.png)
![Chemical structure of tert-butyl 5-bromo-6-[(dimethylcarbamoyl)oxy]-1,2,3,4-tetrahydroisoquinoline-2-carboxylate - CSSB21432559994](/st/structure/200/da0c21ea935d308faa1d1cc093b3d134/CN%2528C%2529C%2528%253DO%2529OC1%253DC%2528Br%2529C2%253DC%2528CN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%253DC1.png)
![Chemical structure of tert-butyl 5-bromo-6-[(diethylcarbamoyl)oxy]-1,2,3,4-tetrahydroisoquinoline-2-carboxylate - CSSB21432560102](/st/structure/200/87af6f37dfc7db1707a53425b8db1cef/CCN%2528CC%2529C%2528%253DO%2529OC1%253DC%2528Br%2529C2%253DC%2528CN%2528CC2%2529C%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%253DC1.png)
![Chemical structure of tert-butyl 5-bromo-6-{[2-(trimethylsilyl)ethoxy]methoxy}-1,2,3,4-tetrahydroisoquinoline-2-carboxylate - CSSB21432560101](/st/structure/200/a1550d8e43ca17f17986b423908cdd33/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1CCC2%253DC%2528C1%2529C%253DCC%2528OCOCC%255BSi%255D%2528C%2529%2528C%2529C%2529%253DC2Br.png)
Similarity Analogs
