MCULE-7458337232
- 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 | 65 USD | 90 | 10 working days | Get Quote |
5 mg | 81 USD | 90 | 10 working days | Get Quote |
10 mg | 111 USD | 90 | 10 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-7458337232.sdf |
SMILES | MCULE-7458337232.smiles |
Standard InChI | MCULE-7458337232.inchi |
InChIKey | MCULE-7458337232.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-852125324 | A2B Chem | Predominantly Building Block on demand | 90 | As is | by synthesis |
P-851388799 | AmBeed | On request | N/A | As is | by synthesis |
P-575334339 | EvoBlocks | In-stock Building Blocks | 95 | As is | in stock |
P-862133503 | FluoroChem | General BB | 95 | As is | in stock |
P-454380914 | Key Organics | Building Blocks | 90 | As is | 6.695 g |
P-18734487 | Key Organics | Screening Compounds and Fragments | 90 | As is | 6.695 g |
P-12353335 | Specs | Screening Compounds | 90 | As is | 12 mg |
Property | Value |
---|---|
Components | 1 |
Mass | 267.103 |
logP | 4.4825 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 3 |
PSA | 30.21 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 68.5345 |
Atoms | 25 |
Rings | 2 |
Heavy atoms | 17 |
Hydrogen atoms | 8 |
Heteroatoms | 4 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 2 |
Chiral centers | 0 |
R/S chiral centers | 0 |
Unknown chiral centers | 0 |
Undefined chiral centers | 0 |
Stereo double bonds | 1 |
Cis/trans stereo double bonds | 0 |
Unknown stereo double bonds | 1 |
Undefined stereo double bonds | 0 |