Methyl 4-tert-butyl-2-nitrobenzoate
Structure Info
- Chemspace ID
- CSSB01128109721 (In-Stock Building Blocks)
- CAS
- 20587-31-9
- IUPAC Name
- methyl 4-tert-butyl-2-nitrobenzoate
- Mol formula
- C12H15NO4
- Mol weight
- 237 Da
- Catalog Number(s)
- BBLS01128109721, CSCR01128109721, EN300-46835456, Z3535070169, bbls01128109721, s_1458_15114668_483916, s_1458____15114668____483916
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.46
- Heavy atoms count
- 17
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.416
- Polar surface area (Å)
- 69
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB01128109721
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 | 455.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 477.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 498.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 519.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 541.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,063.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 1,572.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 2,331.00 |
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Substructure Analogs
Similarity Analogs
![Chemical structure of [4-(methoxycarbonyl)-3-nitrophenyl]boronic acid - CSSB00010255326](/st/structure/200/a40a0225c58d9f7fd52b6fc3de1a440b/COC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%255BN%252B%255D%2528%255BO-%255D%2529%253DO%2529B%2528O%2529O.png)
