MCULE-9973411212
- 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 | 104 USD | 95 | 28 working days | Get Quote |
5 mg | 104 USD | 95 | 28 working days | Get Quote |
10 mg | 104 USD | 95 | 28 working days | Get Quote |
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MCULE-1085876459
- Component type: Main
Name | File |
---|---|
SDF | MCULE-9973411212.sdf |
SMILES | MCULE-9973411212.smiles |
Standard InChI | MCULE-9973411212.inchi |
InChIKey | MCULE-9973411212.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-596220921 | Asinex | General screening catalog | 90 | As is | unavailable |
P-856980369 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
P-886665912 | A2B Chem | Predominantly Building Block in stock | 95 | As a main component | in stock |
P-869313683 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
P-861978248 | FluoroChem | General BB | N/A | As a main component | in stock |
P-862259263 | KISHIDA CHEMICAL | K-BB | 95 | As a main component | 11.974 g |
P-579462132 | Key Organics | Building Blocks | 95 | As a main component | 250 mg |
P-863639596 | Matrix Scientific | All | N/A | As a main component | in stock |
P-854867814 | MedChemExpress | Building Blocks on demand | 95 | As a main component | by synthesis |
Property | Value |
---|---|
Components | 1 |
Mass | 234.294 |
logP | 1.8967 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 4 |
PSA | 50.36 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 69.7609 |
Atoms | 35 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 18 |
Heteroatoms | 4 |
N/O atoms | 4 |
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 |