Drug-likeness Properties
sLogP
3.88102
HBD
0
HBA
3
AS69000-G1
Halides
Ketones
2-Bromo-1-[3-(4-chloro-phenyl)-5-methyl-isoxazol-4-yl]-ethanone 95%
CAS: 1159981-10-8
Molecular Formula
C12H9BrClNO2
Molecular Weight
314.56
MDL
MFCD11656448
Unit Size
Price per 1 g
€204.00
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PRODUCT ATTACHED TO REQUEST:
2-Bromo-1-[3-(4-chloro-phenyl)-5-methyl-isoxazol-4-yl]-ethanone 95%
Catalogue Number: AS69000-G1
C.A.S / related C.A.S
1159981-10-8
Quality Guarantee
All products are tested and certified with CoA available upon request.
AS69000-G1
General Information
| Catalog #: | AS69000-G1 |
|---|---|
| Formula: | C12H9BrClNO2 |
| Mass: | 314.56 |
| C.A.S. / related C.A.S: | 1159981-10-8 |
| MDL: | MFCD11656448 |
| 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: | 3.88102 |
|---|---|
| LabuteASA: | 111.8809932 |
| TPSA: | 43.1 |
| NumRotatableBonds: | 3 |
| NumHBD: | 0 |
| NumHBA: | 3 |
| NumHeavyAtoms: | 17 |
| NumRings: | 2 |