Structure Info
- Chemspace ID
- CSCS00021651239 (Synthesis)
- MFCD
- MFCD28736794
- IUPAC Name
- methyl 2-bromo-3-cyano-6-nitrobenzoate
- Mol formula
- C9H5BrN2O4
- Mol weight
- 285 Da
- Catalog Number(s)
- A015009331, BBV-78108973, CSC021651239, FCH3618971
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.54
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.111
- Polar surface area (Å)
- 93
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00021651239
Items Overall 2 items from 2 suppliers
Supplier | Lead time | Ships from | Purity | Pack | Price, € | Qty |
---|---|---|---|---|---|---|
Alichem | TBD | United States To: | 95 | 1 g | POA | |
Description: CAS: 1805520-74-4 | ||||||
Enamine MADE BBs | TBD | Ukraine To: | 95 | 1 g | POA |
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