Structure Info
- Chemspace ID
- CSSB00000645094 (In-Stock Building Blocks)
- CAS
- 1017038-09-3, 1016871-06-9
- MFCD
- MFCD09950374
- IUPAC Name
- 4,5-dimethoxy-2-(prop-2-ynamido)benzoic acid
- Mol formula
- C12H11NO5
- Mol weight
- 249 Da
- Catalog Number(s)
- AR01C40C, AW43584, ArZ-UP167602, ArZ-UP215866, BB4LS-EN300-254950, BBV-088613, BD01065634, BVV-820800082, CSC000645094, EN300-254950, Y3196303, Z316091286, ZX-NM193582, ZX-NM210877
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.61
- Heavy atoms count
- 18
- Rotatable bond count
- 4
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.166
- Polar surface area (Å)
- 85
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 2
- Zoom the structure
- CSSB00000645094
Items Overall 14 items from 3 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine US | 2 days | United States To: | 95 | 100 mg | 312 | |
| Enamine US | 2 days | United States To: | 95 | 250 mg | 445 | |
| Enamine US | 2 days | United States To: | 95 | 500 mg | 702 | |
| Enamine US | 2 days | United States To: | 95 | 1 g | 900 | |
| Enamine Ltd | 15 days | Ukraine To: | 95 | 100 mg | 312 | |
| Enamine Ltd | 15 days | Ukraine To: | 95 | 250 mg | 445 | |
| Enamine Ltd | 15 days | Ukraine To: | 95 | 500 mg | 702 | |
| Enamine Ltd | 15 days | Ukraine To: | 95 | 1 g | 900 | |
| Enamine Ltd | 15 days | Ukraine To: | 95 | 2.5 g | 1,764 | |
| UORSY | 15 days | Ukraine To: | 95 | 100 mg | 312 | |
| UORSY | 15 days | Ukraine To: | 95 | 250 mg | 445 | |
| UORSY | 15 days | Ukraine To: | 95 | 500 mg | 702 | |
| UORSY | 15 days | Ukraine To: | 95 | 1 g | 900 | |
| UORSY | 15 days | Ukraine To: | 95 | 2.5 g | 1,764 |
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