Structure Info
- Chemspace ID
- CSSS00020607249 (In-Stock Screening Compounds)
- MFCD
- MFCD00115235
- IUPAC Name
- (2E)-3-(2H-1,3-benzodioxol-5-yl)-1-(3-nitrophenyl)prop-2-en-1-one
- Mol formula
- C16H11NO5
- Mol weight
- 297 Da
- Catalog Number(s)
- 6017166, AA00JU1I, AGNPC-0WCBDV, CSC020607249, JH46966, LN00182041, ZX-RC017288
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.45
- Heavy atoms count
- 22
- Rotatable bond count
- 4
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.062
- Polar surface area (Å)
- 79
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS00020607249
Items Overall 1 item from 1 supplier
Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
---|---|---|---|---|---|---|
ChemBridge Corp. | 14 days | United States To: | 90 | 1 mg | 68 | |
Description: Name: 3-(1,3-benzodioxol-5-yl)-1-(3-nitrophenyl)-2-propen-1-one; Stereochemistry: achiral; Compound state: solid |
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