Methyl 5-bromo-2-{[(tert-butoxy)carbonyl]amino}benzoate
Structure Info
- Chemspace ID
- CSSB00040192687 (In-Stock Building Blocks)
- CAS
- 851314-03-9
- MFCD
- MFCD16877065, MFCD07782000, MFCD16877065
- IUPAC Name
- methyl 5-bromo-2-{[(tert-butoxy)carbonyl]amino}benzoate
- Mol formula
- C13H16BrNO4
- Mol weight
- 330 Da
- Catalog Number(s)
- A665166, AA020M99, ACEOVR583, AD252275, ADB4189111001, AG020MC1, AR020N11, BBLS00040192687, BBV-534555, BD01617300, BH87977, CS-0529758, CSC040192687, EC020OHT, EN300-198332, F782089, F94588, FCH6872339, G75842, HY-W451820, OR1006688, ST020NST, TX020NHP, Y3291953, Y4250804, Y6221885, bbls00040192687
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.66
- Heavy atoms count
- 19
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.384
- Polar surface area (Å)
- 65
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of Methyl 5-bromo-2-{[(tert-butoxy)carbonyl]amino}benzoate (C13H16BrNO4) - CSSB00040192687](/st/structure/200/9b892cbb0023ecfbffb40d4b5735b45d/COC%2528%253DO%2529C1%253DCC%2528Br%2529%253DCC%253DC1NC%2528%253DO%2529OC%2528C%2529%2528C%2529C.png "C13H16BrNO4")
- Zoom the structure
- CSSB00040192687
Items Overall 28 items from 13 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| ChemScene CN | 5 days | China To: | 95 | 100 mg | 250.00 | |
| ChemScene CN | 5 days | China To: | 95 | 500 mg | 500.00 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
| 1st Scientific LLC | 7 days | United States To: | 98 | 100 mg | 314.60 | |
| 1st Scientific LLC | 7 days | United States To: | 98 | 500 mg | 589.60 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
| Angene International Limited | 10 days | China To: | 95 | 100 mg | 279.00 | |
| Angene International Limited | 10 days | China To: | 95 | 500 mg | 556.20 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
| AiFChem CN | 10 days | China To: | 95 | 100 mg | 324.00 | |
Description: Methyl 5-bromo-2-((tert-butoxycarbonyl)amino)benzoate; CAS: 851314-03-9 | ||||||
| Astatech CN | 10 days | China To: | 95 | 100 mg | 327.80 | |
Description: AN-12-H5 INTERMEDIATE-3; CAS: 851314-03-9 | ||||||
| Advanced ChemBlocks CN | 10 days | China To: | 95 | 100 mg | 350.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 95 | 250 mg | 700.00 | |
| Advanced ChemBlocks CN | 10 days | China To: | 95 | 1 g | 1,820.00 | |
Description: Methyl 5-bromo-2-[[(1,1-dimethylethoxy)carbonyl]amino]benzoate; CAS: 851314-03-9 | ||||||
| A2B Chem | 12 days | United States To: | 95 | 100 mg | 273.70 | |
| A2B Chem | 12 days | United States To: | 95 | 500 mg | 546.25 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
| Aaron Chemicals LLC | 12 days | United States To: | 95 | 100 mg | 387.55 | |
| Aaron Chemicals LLC | 12 days | United States To: | 95 | 500 mg | 775.10 | |
| Fluorochem CN | 14 days | China To: | 95 | 100 mg | 313.00 | |
| Fluorochem CN | 14 days | China To: | 95 | 500 mg | 616.00 | |
Description: Methyl 5-bromo-2-((tert-butoxycarbonyl)amino)benzoate; ; Storage Conditions: ambient storage; Hazard Codes: H302, H315, H319, H335; GHS Pictograms: GHS07; CAS: 851314-03-9 | ||||||
| BB4LS GS | 15 days | Germany To: | 95 | 50 umol | 340.20 | |
| BB4LS GS | 15 days | Germany To: | 95 | 100 umol | 346.50 | |
| BB4LS GS | 15 days | Germany To: | 95 | 200 umol | 352.80 | |
| BB4LS GS | 15 days | Germany To: | 95 | 300 umol | 718.20 | |
| BB4LS GS | 15 days | Germany To: | 95 | 500 umol | 730.80 | |
| eNovation CN | 20 days | China To: | 95 | 100 mg | 287.50 | |
| eNovation CN | 20 days | China To: | 95 | 500 mg | 557.75 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
| Accel Scientific, S.L. | 20 days | China To: | 95 | 100 mg | 374.00 | |
| Accel Scientific, S.L. | 20 days | China To: | 95 | 500 mg | 746.90 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
| 10X CHEM | TBD | United States To: | 98 | 100 mg | 322.30 | |
| 10X CHEM | TBD | United States To: | 98 | 500 mg | 606.10 | |
Description: AN-12-H5 intermediate-3; CAS: 851314-03-9 | ||||||
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Substructure Analogs
Similarity Analogs
![Chemical structure of methyl 4-bromo-2-{[(tert-butoxy)carbonyl]amino}benzoate - CSSB00114107742](/st/structure/200/17bc42ba32e8fb91e90c2a1aa94a4d06/COC%2528%253DO%2529C1%253DCC%253DC%2528Br%2529C%253DC1NC%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of methyl 2-{[(tert-butoxy)carbonyl]amino}-5-fluorobenzoate - CSSB00012224052](/st/structure/200/fc51423f2f16c3de7b30ceb72d751ce5/COC%2528%253DO%2529C1%253DCC%2528F%2529%253DCC%253DC1NC%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of methyl 5-bromo-3-{[(tert-butoxy)carbonyl]amino}-2-methylbenzoate - CSSB03496569282](/st/structure/200/8f838aa17b4b8f674581b347845cace0/COC%2528%253DO%2529C1%253DCC%2528Br%2529%253DCC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DC1C.png)
![Chemical structure of methyl 5-bromo-2-(2-{[(tert-butoxy)carbonyl]amino}acetamido)benzoate - CSSB06630656056](/st/structure/200/8d15cc00c596d4c510d6d3a454736e5c/COC%2528%253DO%2529c1cc%2528Br%2529ccc1NC%2528%253DO%2529CNC%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of methyl 2-{[(tert-butoxy)carbonyl]amino}benzoate - CSSB00011326961](/st/structure/200/226d04a7ccf417250a84283e3bd15037/COC%2528%253DO%2529C1%253DCC%253DCC%253DC1NC%2528%253DO%2529OC%2528C%2529%2528C%2529C.png)
![Chemical structure of methyl 2-{[(tert-butoxy)carbonyl]amino}-5-tert-butylbenzoate - CSSB03554590746](/st/structure/200/041425be73606d613019961ab1aeeb4a/COC%2528%253DO%2529c1cc%2528ccc1NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529C%2528C%2529%2528C%2529C.png)
![Chemical structure of methyl 3-{[(tert-butoxy)carbonyl]amino}-2-fluorobenzoate - CSSB00010409847](/st/structure/200/3552d9e0c09a5d75bdf3e15a9c4a5a57/COC%2528%253DO%2529C1%253DCC%253DCC%2528NC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529%253DC1F.png)
