Rac-(2R,3S)-2-(acetamidomethyl)-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid
Structure Info
- Chemspace ID
- CSSB20620674451 (In-Stock Building Blocks)
- CAS
- 2679812-88-3
- IUPAC Name
- rac-(2R,3S)-2-(acetamidomethyl)-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid
- Mol formula
- C13H15NO4
- Mol weight
- 249 Da
- Catalog Number(s)
- EN300-28278395
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.96
- Heavy atoms count
- 18
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.384
- Polar surface area (Å)
- 76
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSB20620674451
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 | 1,224.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 1,284.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 1,341.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 1,400.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 1,458.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 2,856.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 4,226.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 6,266.00 |
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Substructure Analogs
![Chemical structure of rac-methyl (2R,3S)-3-methyl-2-[(prop-2-enamido)methyl]-2,3-dihydro-1-benzofuran-5-carboxylate - CSSB21332073635](/st/structure/200/2fed6837cb34f62f4c9bb8137e570eba/COC%2528%253DO%2529C1%253DCC2%253DC%2528O%255BC%2540H%255D%2528CNC%2528%253DO%2529C%253DC%2529%255BC%2540%2540H%255D2C%2529C%253DC1%2B%257C%25261%253A9%252C16%252Cr%257C.png)
![Chemical structure of rac-methyl (2R,3S)-2-[(2-chloroacetamido)methyl]-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylate - CSSB21332098166](/st/structure/200/008005e198644825bccabe4c87fe405d/COC%2528%253DO%2529C1%253DCC2%253DC%2528O%255BC%2540H%255D%2528CNC%2528%253DO%2529CCl%2529%255BC%2540%2540H%255D2C%2529C%253DC1%2B%257C%25261%253A9%252C16%252Cr%257C.png)
![Chemical structure of rac-methyl (2R,3S)-2-[(2-chloro-2-fluoroacetamido)methyl]-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylate - CSSB21332121810](/st/structure/200/6042e3d8998837ab33c5898682a39a9b/COC%2528%253DO%2529C1%253DCC2%253DC%2528O%255BC%2540H%255D%2528CNC%2528%253DO%2529C%2528F%2529Cl%2529%255BC%2540%2540H%255D2C%2529C%253DC1%2B%257C%25261%253A9%252C17%252Cr%257C.png)
Similarity Analogs
![Chemical structure of rac-(2R,3S)-3-methyl-2-[(2,2,2-trifluoroacetamido)methyl]-2,3-dihydro-1-benzofuran-5-carboxylic acid - CSSB03609082653](/st/structure/200/ab854629346d6aaedaa0eb6fe9c97f38/C%255BC%2540%2540H%255D1%255BC%2540H%255D%2528CNC%2528%253DO%2529C%2528F%2529%2528F%2529F%2529Oc2ccc%2528cc12%2529C%2528%253DO%2529O%2B%257C%25261%253A1%252C2%252Cr%257C.png)
![Chemical structure of rac-(2R,3S)-2-({[(tert-butoxy)carbonyl]amino}methyl)-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid - CSSB02134477556](/st/structure/200/5bf0a97a11d8171718a1b85654397150/C%255BC%2540%2540H%255D1%255BC%2540H%255D%2528CNC%2528%253DO%2529OC%2528C%2529%2528C%2529C%2529OC2%253DCC%253DC%2528C%253DC12%2529C%2528O%2529%253DO%2B%257C%25261%253A1%252C2%252Cr%257C.png)
![Chemical structure of rac-(2R,3S)-2-({[(benzyloxy)carbonyl]amino}methyl)-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid - CSSB02134477448](/st/structure/200/7f9df8b5eeb243e847b2ddbc31db42bf/C%255BC%2540%2540H%255D1%255BC%2540H%255D%2528CNC%2528%253DO%2529OCC2%253DCC%253DCC%253DC2%2529OC2%253DCC%253DC%2528C%253DC12%2529C%2528O%2529%253DO%2B%257C%25261%253A1%252C2%252Cr%257C.png)
![Chemical structure of rac-(2R,3S)-2-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-3-methyl-2,3-dihydro-1-benzofuran-5-carboxylic acid - CSSB02125425616](/st/structure/200/142c52d016d1d8a680948efc5347ad48/C%255BC%2540%2540H%255D1%255BC%2540H%255D%2528CNC%2528%253DO%2529OCC2C3%253DC%2528C%253DCC%253DC3%2529C3%253DC2C%253DCC%253DC3%2529OC2%253DC1C%253DC%2528C%253DC2%2529C%2528O%2529%253DO%2B%257C%25261%253A1%252C2%252Cr%257C.png)
