Drug-likeness Properties
sLogP
4.88578
HBD
0
HBA
3
AS68591-G1
Halides
Sulfur functional groups
Fluorides
Pyridine
2-Cyano-3-(4-bromophenylsulfanyl)-5-(trifluoromethyl)pyridine 95%
CAS: 1449117-27-4
Molecular Formula
C13H6BrF3N2S
Molecular Weight
359.16
MDL
MFCD25970578
Unit Size
Price per 1 g
€403.00
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PRODUCT ATTACHED TO REQUEST:
2-Cyano-3-(4-bromophenylsulfanyl)-5-(trifluoromethyl)pyridine 95%
Catalogue Number: AS68591-G1
C.A.S / related C.A.S
1449117-27-4
Quality Guarantee
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AS68591-G1
General Information
| Catalog #: | AS68591-G1 |
|---|---|
| Formula: | C13H6BrF3N2S |
| Mass: | 359.16 |
| C.A.S. / related C.A.S: | 1449117-27-4 |
| MDL: | MFCD25970578 |
| Appearance: | solid |
| Colour: | clear |
| 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: | 4.88578 |
|---|---|
| LabuteASA: | 125.3178731 |
| TPSA: | 36.68 |
| NumRotatableBonds: | 2 |
| NumHBD: | 0 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 20 |
| NumRings: | 2 |