Drug-likeness Properties
sLogP
1.66908
HBD
0
HBA
4
AS43497-G1
Ketones
Benzene
5-Acetyl-2-nitrobenzonitrile 96%
CAS: 223726-10-1
Molecular Formula
C9H6N2O3
Molecular Weight
190.16
MDL
MFCD23701502
Unit Size
Price per 1 g
€193.00
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PRODUCT ATTACHED TO REQUEST:
5-Acetyl-2-nitrobenzonitrile 96%
Catalogue Number: AS43497-G1
C.A.S / related C.A.S
223726-10-1
Quality Guarantee
All products are tested and certified with CoA available upon request.
AS43497-G1
General Information
| Catalog #: | AS43497-G1 |
|---|---|
| Formula: | C9H6N2O3 |
| Mass: | 190.16 |
| C.A.S. / related C.A.S: | 223726-10-1 |
| MDL: | MFCD23701502 |
| Appearance: | solid |
| Colour: | light yellow to yellow |
| Hazardous Classification: | Giftig (Toxic) |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2926907090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 1.66908 |
|---|---|
| LabuteASA: | 79.73330697 |
| TPSA: | 84 |
| NumRotatableBonds: | 2 |
| NumHBD: | 0 |
| NumHBA: | 4 |
| NumHeavyAtoms: | 14 |
| NumRings: | 1 |