Drug-likeness Properties
sLogP
2.39858
HBD
1
HBA
3
AS133533-G1
Alcohol
Halides
Fluorides
Pyridine
3-(6-Chloro-3-pyridyl)-4,4,4-trifluoro-3-hydroxybutanenitrile 95%
CAS: –
Molecular Formula
C9H6ClF3N2O
Molecular Weight
250.60
MDL
MFCD32202776
Unit Size
Price per 1 g
€1,115.00
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3-(6-Chloro-3-pyridyl)-4,4,4-trifluoro-3-hydroxybutanenitrile 95%
Catalogue Number: AS133533-G1
C.A.S / related C.A.S
—
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AS133533-G1
General Information
| Catalog #: | AS133533-G1 |
|---|---|
| Formula: | C9H6ClF3N2O |
| Mass: | 250.60 |
| C.A.S. / related C.A.S: | |
| MDL: | MFCD32202776 |
| Appearance: | |
| Colour: | |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2933399990 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 2.39858 |
|---|---|
| LabuteASA: | 94.09750543 |
| TPSA: | 56.91 |
| NumRotatableBonds: | 2 |
| NumHBD: | 1 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 16 |
| NumRings: | 1 |