Drug-likeness Properties
sLogP
2.43378
HBD
0
HBA
3
AS101617-G1
Ketones
Fluorides
Benzene
3-Methoxy-a-trifluoroacetyl-benzeneacetonitrile 97%
CAS: 22102-04-1
Molecular Formula
C11H8F3NO2
Molecular Weight
243.18
MDL
MFCD09878884
Unit Size
Price per 1 g
€523.00
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3-Methoxy-a-trifluoroacetyl-benzeneacetonitrile 97%
Catalogue Number: AS101617-G1
C.A.S / related C.A.S
22102-04-1
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All products are tested and certified with CoA available upon request.
AS101617-G1
General Information
| Catalog #: | AS101617-G1 |
|---|---|
| Formula: | C11H8F3NO2 |
| Mass: | 243.18 |
| C.A.S. / related C.A.S: | 22102-04-1 |
| MDL: | MFCD09878884 |
| 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: | 2.43378 |
|---|---|
| LabuteASA: | 95.42036691 |
| TPSA: | 50.09 |
| NumRotatableBonds: | 3 |
| NumHBD: | 0 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 17 |
| NumRings: | 1 |