5-bromo-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid
Structure Info
- Chemspace ID
- CSSB00010477155 (In-Stock Building Blocks)
- CAS
- 1822579-99-6
- MFCD
- MFCD24533107, MFCD24533107
- IUPAC Name
- 5-bromo-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid
- Mol formula
- C14H16BrNO4
- Mol weight
- 342 Da
- Catalog Number(s)
- AR01RXZD, BBLS00010477155, BBV-45283520, CSC010477155, EN300-23701470, FCH1845113, ST01RYR5, TX01RYG1, bbls00010477155
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.25
- Heavy atoms count
- 20
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.428
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
![Chemical structure of 5-bromo-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid (C14H16BrNO4) - CSSB00010477155](/st/structure/200/bb3bb16341418e9913cd9092f1fbc883/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%2528CC2%253DCC%2528Br%2529%253DCC%253DC12%2529C%2528O%2529%253DO.png "C14H16BrNO4")
- Zoom the structure
- CSSB00010477155
Items Overall 31 items from 5 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 137.88 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 191.74 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 273.00 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 334.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 413.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 222.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 331.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 473.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 746.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 956.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 1,874.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 2,774.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 4,114.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 222.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 331.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 473.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 746.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 956.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 1,874.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 137.88 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 191.74 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 273.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 334.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 413.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 310.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 436.70 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 601.70 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 917.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 1,160.50 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 2.5 g | 2,223.10 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 5 g | 3,264.80 | |
Description: 1H-Indole-1,2-dicarboxylic acid, 5-bromo-2,3-dihydro-, 1-(1,1-dimethylethyl) ester; CAS: 1822579-99-6 | ||||||
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Substructure Analogs
![Chemical structure of 5,7-dibromo-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB00025795418](/st/structure/200/5e2858898a2cb7be101b608f586fedb0/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%2528CC2%253DCC%2528Br%2529%253DCC%2528Br%2529%253DC12%2529C%2528O%2529%253DO.png)
Similarity Analogs
![Chemical structure of 6-bromo-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB00010476005](/st/structure/200/037bd1363c226f2d694b741b05499b79/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%2528CC2%253DCC%253DC%2528Br%2529C%253DC12%2529C%2528O%2529%253DO.png)
![Chemical structure of 6-bromo-1-[(tert-butoxy)carbonyl]-1,2,3,4-tetrahydroquinoline-2-carboxylic acid - CSSB00102743551](/st/structure/200/d19cecf2799deb0180e0bffd57f20db9/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%2528CCC2%253DCC%2528Br%2529%253DCC%253DC12%2529C%2528O%2529%253DO.png)
![Chemical structure of 1-[(tert-butoxy)carbonyl]-5-chloro-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB00160484078](/st/structure/200/4d51573b8b1891d0e9d3d144af7be913/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%2528CC2%253DCC%2528Cl%2529%253DCC%253DC12%2529C%2528O%2529%253DO.png)
![Chemical structure of (2S)-1-[(tert-butoxy)carbonyl]-5-chloro-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB02126885592](/st/structure/200/4c78881e69f537eee1de90a95f6278b8/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1%255BC%2540%2540H%255D%2528CC2%253DCC%2528Cl%2529%253DCC%253DC12%2529C%2528O%2529%253DO.png)
![Chemical structure of (2R)-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB00010210506](/st/structure/200/05ada7df9da91e7065749e4d38baa46b/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1%255BC%2540H%255D%2528CC2%253DCC%253DCC%253DC12%2529C%2528O%2529%253DO.png)
![Chemical structure of 1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB00000687758](/st/structure/200/3268e189278621b033fb60973e6274fc/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1C%2528CC2%253DCC%253DCC%253DC12%2529C%2528O%2529%253DO.png)
![Chemical structure of (2S)-1-[(tert-butoxy)carbonyl]-2,3-dihydro-1H-indole-2-carboxylic acid - CSSB00011418069](/st/structure/200/6f07c6542e8651a3fdafe7ad4b2a737e/CC%2528C%2529%2528C%2529OC%2528%253DO%2529N1%255BC%2540%2540H%255D%2528CC2%253DCC%253DCC%253DC12%2529C%2528O%2529%253DO.png)
