MCULE-8310739964
- InChIKey:
- SMILES:
- InChI:
- Formula:
Amount | Price
Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
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Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
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1 mg | 161 USD | 95 | 35 working days | Get Quote |
5 mg | 161 USD | 95 | 35 working days | Get Quote |
10 mg | 161 USD | 95 | 35 working days | Get Quote |
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MCULE-7990896525
- Component type: Main
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MCULE-5089569252
- Component type: Main
Name | File |
---|---|
SDF | MCULE-8310739964.sdf |
SMILES | MCULE-8310739964.smiles |
Standard InChI | MCULE-8310739964.inchi |
InChIKey | MCULE-8310739964.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-867494026 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
P-596346399 | Asinex | General screening catalog | 90 | As is | 6 mg |
P-895344377 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
P-612872161 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
P-619275655 | ChemDiv | Discovery Chemistry Library | 90 | As a main component | unavailable |
P-862059565 | FluoroChem | General BB | 95 | As a main component | in stock |
P-855951957 | Key Organics | Building Blocks | 95 | As a main component | 5 g |
Property | Value |
---|---|
Components | 1 |
Mass | 242.359 |
logP | 4.0236 |
H-bond acceptors | 2 |
H-bond donors | 2 |
Rotatable bonds | 4 |
PSA | 27.82 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 77.6014 |
Atoms | 40 |
Rings | 3 |
Heavy atoms | 18 |
Hydrogen atoms | 22 |
Heteroatoms | 2 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 0 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 0 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |