Drug-likeness Properties
sLogP
3.11072
HBD
1
HBA
3
AS69480-G1
Halides
Carboxylic acids
5-(2-Bromo-phenyl)-3-methyl-isoxazole-4-carboxylic acid 95%
CAS: 91182-59-1
Molecular Formula
C11H8BrNO3
Molecular Weight
282.09
MDL
MFCD21362497
Unit Size
Price per 1 g
€283.00
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PRODUCT ATTACHED TO REQUEST:
5-(2-Bromo-phenyl)-3-methyl-isoxazole-4-carboxylic acid 95%
Catalogue Number: AS69480-G1
C.A.S / related C.A.S
91182-59-1
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All products are tested and certified with CoA available upon request.
AS69480-G1
General Information
| Catalog #: | AS69480-G1 |
|---|---|
| Formula: | C11H8BrNO3 |
| Mass: | 282.09 |
| C.A.S. / related C.A.S: | 91182-59-1 |
| MDL: | MFCD21362497 |
| Appearance: | |
| Colour: | |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2934999090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 3.11072 |
|---|---|
| LabuteASA: | 100.0070186 |
| TPSA: | 63.33 |
| NumRotatableBonds: | 2 |
| NumHBD: | 1 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 16 |
| NumRings: | 2 |