Drug-likeness Properties
sLogP
3.34348
HBD
0
HBA
3
AS130864-G1
Fluorides
Cyclopentane
1-(2,2-Difluoro-1,3-benzodioxol-5-yl)cyclopentanecarbonitrile 95%
CAS: 2119512-46-6
Molecular Formula
C13H11F2NO2
Molecular Weight
251.23
MDL
MFCD31653102
Unit Size
Price per 1 g
€1,022.00
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PRODUCT ATTACHED TO REQUEST:
1-(2,2-Difluoro-1,3-benzodioxol-5-yl)cyclopentanecarbonitrile 95%
Catalogue Number: AS130864-G1
C.A.S / related C.A.S
2119512-46-6
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AS130864-G1
General Information
| Catalog #: | AS130864-G1 |
|---|---|
| Formula: | C13H11F2NO2 |
| Mass: | 251.23 |
| C.A.S. / related C.A.S: | 2119512-46-6 |
| MDL: | MFCD31653102 |
| Appearance: | solid |
| Colour: | clear |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2932990090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 3.34348 |
|---|---|
| LabuteASA: | 102.9250766 |
| TPSA: | 42.25 |
| NumRotatableBonds: | 1 |
| NumHBD: | 0 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 18 |
| NumRings: | 3 |