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UNKNOWN STEREO
MCULE-1200159118
Compound
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- 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.
|
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.
|
|
|---|---|---|---|---|
| 1 mg | 7 USD | 97 | 20 working days | Get Quote |
| 5 mg | 7 USD | 97 | 20 working days | Get Quote |
| 10 mg | 7 USD | 97 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1200159118.sdf |
| SMILES | MCULE-1200159118.smiles |
| Standard InChI | MCULE-1200159118.inchi |
| InChIKey | MCULE-1200159118.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867547697 | 98 | As is | in stock |
| P-875705278 | 97 | As is | in stock |
| P-1275159643 | 95 | As is | in stock |
| P-1275177063 | 98 | As is | in stock |
| P-492323116 | 95 | As is | in stock |
| P-1270335613 | 97 | As is | in stock |
| P-606903103 | N/A | As is | in stock |
| P-596940271 | 97 | As is | 200 g |
| P-864110793 | 97 | As is | in stock |
| P-1274380566 | 95 | As is | by synthesis |
| P-580444063 | 95 | As is | by resynthesis (? - ? days) |
| P-505530762 | 95 | As is | in stock |
| P-428002087 | 90 | As is | in stock |
| P-500375712 | 99 | As is | by synthesis |
| P-500375713 | 96 | As is | by synthesis |
| P-1274334642 | 95 | As is | unavailable |
| P-892262811 | 95 | As is | 135 mg |
| P-892344177 | 95 | As is | 135 mg |
| P-855035148 | 90 | As is | in stock |
| P-855104180 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 131.173 |
| logP | 1.1447 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 35.4352 |
| Atoms | 22 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
