MCULE-1113222985
- 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 | 13 USD | 98 | 11 working days | Get Quote |
5 mg | 13 USD | 98 | 11 working days | Get Quote |
10 mg | 13 USD | 98 | 11 working days | Get Quote |
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Name | File |
---|---|
SDF | MCULE-1113222985.sdf |
SMILES | MCULE-1113222985.smiles |
Standard InChI | MCULE-1113222985.inchi |
InChIKey | MCULE-1113222985.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-875729488 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
P-489119991 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
P-889740712 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 2.4 kg |
P-881633715 | Chemfaces | Natural Compounds | 98 | As is | in stock |
P-868612616 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
P-852504791 | Matrix Scientific | All | N/A | As is | in stock |
P-854693510 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
P-896629416 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
P-584621128 | MedKoo | In stock compounds | 95 | As is | in stock |
P-619672475 | Molnova | Stock | 98 | As is | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 116.072 |
logP | -0.2882 |
H-bond acceptors | 4 |
H-bond donors | 2 |
Rotatable bonds | 2 |
PSA | 74.6 |
RO5 violations | 0 |
RO3 violations | 2 |
Refractivity | 24.4116 |
Atoms | 12 |
Rings | 0 |
Heavy atoms | 8 |
Hydrogen atoms | 4 |
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 | 1 |
Cis/trans stereo double bonds | 1 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 0 |