Drug-likeness Properties
sLogP
3.80558
HBD
2
HBA
4
AS69868-G1
Halides
Sulfur functional groups
Fluorides
2-(3-Chloro-5-trifluoromethyl-pyridin-2-yl)-3,3-dimercapto-acrylonitrile 95%
CAS: 1431555-26-8
Molecular Formula
C9H4ClF3N2S2
Molecular Weight
296.72
MDL
MFCD24386164
Unit Size
Price per 1 g
€215.00
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PRODUCT ATTACHED TO REQUEST:
2-(3-Chloro-5-trifluoromethyl-pyridin-2-yl)-3,3-dimercapto-acrylonitrile 95%
Catalogue Number: AS69868-G1
C.A.S / related C.A.S
1431555-26-8
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AS69868-G1
General Information
| Catalog #: | AS69868-G1 |
|---|---|
| Formula: | C9H4ClF3N2S2 |
| Mass: | 296.72 |
| C.A.S. / related C.A.S: | 1431555-26-8 |
| MDL: | MFCD24386164 |
| Appearance: | |
| Colour: | |
| Hazardous Classification: | Giftig (Toxic) |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2933399990 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 3.80558 |
|---|---|
| LabuteASA: | 110.923802 |
| TPSA: | 36.68 |
| NumRotatableBonds: | 1 |
| NumHBD: | 2 |
| NumHBA: | 4 |
| NumHeavyAtoms: | 17 |
| NumRings: | 1 |