Drug-likeness Properties
sLogP
5.0856
HBD
0
HBA
4
AS280472-MG100
Halides
Fluorides
Indole
1-Boc-5-bromo-6-(trifluoromethoxy)-1H-indole 98%
CAS: 2227479-96-9
Molecular Formula
C14H13BrF3NO3
Molecular Weight
380.15
MDL
MFCD34663363
Unit Size
Price per 100 mg
€206.00
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PRODUCT ATTACHED TO REQUEST:
1-Boc-5-bromo-6-(trifluoromethoxy)-1H-indole 98%
Catalogue Number: AS280472-MG100
C.A.S / related C.A.S
2227479-96-9
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AS280472-MG100
General Information
| Catalog #: | AS280472-MG100 |
|---|---|
| Formula: | C14H13BrF3NO3 |
| Mass: | 380.15 |
| C.A.S. / related C.A.S: | 2227479-96-9 |
| MDL: | MFCD34663363 |
| Appearance: | |
| Colour: | |
| Hazardous Classification: | Achtung / Warning |
| Storage Temp: | 2-7°C Kühlschrank / Refrigerate |
| Dangerous Goods in Excepted Quantities: | |
| Tariff Code: | 2933998090 |
| Stock: | 0 |
| Material Safety Data Sheet: |
Computational Information
| SlogP: | 5.0856 |
|---|---|
| LabuteASA: | 132.4746186 |
| TPSA: | 40.46 |
| NumRotatableBonds: | 1 |
| NumHBD: | 0 |
| NumHBA: | 4 |
| NumHeavyAtoms: | 22 |
| NumRings: | 2 |