Drug-likeness Properties
sLogP
3.18958
HBD
0
HBA
2
AS101666-G1
Halides
Ketones
Benzene
a-Acetyl-3,4-dichlorobenzeneacetonitrile 97%
CAS: 6097-31-0
Molecular Formula
C10H7Cl2NO
Molecular Weight
228.07
MDL
MFCD13248620
Unit Size
Price per 1 g
€523.00
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PRODUCT ATTACHED TO REQUEST:
a-Acetyl-3,4-dichlorobenzeneacetonitrile 97%
Catalogue Number: AS101666-G1
C.A.S / related C.A.S
6097-31-0
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All products are tested and certified with CoA available upon request.
AS101666-G1
General Information
| Catalog #: | AS101666-G1 |
|---|---|
| Formula: | C10H7Cl2NO |
| Mass: | 228.07 |
| C.A.S. / related C.A.S: | 6097-31-0 |
| MDL: | MFCD13248620 |
| Appearance: | solid |
| Colour: | clear |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2926907090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 3.18958 |
|---|---|
| LabuteASA: | 92.05180581 |
| TPSA: | 40.86 |
| NumRotatableBonds: | 2 |
| NumHBD: | 0 |
| NumHBA: | 2 |
| NumHeavyAtoms: | 14 |
| NumRings: | 1 |