MCULE-4399518565
- 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 | 5 USD | 95 | 14 working days | Get Quote |
| 5 mg | 5 USD | 95 | 14 working days | Get Quote |
| 10 mg | 5 USD | 95 | 14 working days | Get Quote |
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MCULE-3773548979
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4399518565.sdf |
| SMILES | MCULE-4399518565.smiles |
| Standard InChI | MCULE-4399518565.inchi |
| InChIKey | MCULE-4399518565.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867573283 | 95 | As is | in stock |
| P-875734412 | 95 | As is | in stock |
| P-1275143713 | 95 | As is | in stock |
| P-1275174788 | 98 | As is | in stock |
| P-903064145 | 95 | As is | 2 kg |
| P-905480996 | 97 | As is | 10 g |
| P-610955067 | 90 | As is | 13.4052 kg |
| P-901168336 | 98 | As is | in stock |
| P-1270390959 | 95 | As is | in stock |
| P-580241093 | 95 | As is | by synthesis |
| P-606919421 | N/A | As is | in stock |
| P-489117251 | 97 | As is | in stock |
| P-596950468 | 98 | As is | 10 kg |
| P-494351197 | 95 | As is | 104.47 g |
| P-869992715 | 90 | As is | 1000 mg |
| P-864099513 | 95 | As is | in stock |
| P-481169705 | 95 | As is | 20 g |
| P-580721211 | 95 | As is | 716 g |
| P-893233813 | 95 | As is | in stock |
| P-492250314 | 95 | As is | in stock |
| P-454685532 | 90 | As is | in stock |
| P-454754739 | 90 | As is | in stock |
| P-15151598 | 90 | As is | 9.995 g |
| P-505605149 | 95 | As is | by synthesis |
| P-436443518 | 90 | As is | 49.98 g |
| P-330560 | 90 | As is | 907 mg |
| P-436445848 | 95 | As is | in stock |
| P-20013149 | 90 | As is | in stock |
| P-851243352 | 95 | As is | by synthesis |
| P-861280274 | 97 | As is | in stock |
| P-868566063 | 98 | As is | in stock |
| P-34801843 | 90 | As is | by synthesis |
| P-580775026 | 90 | As is | by resynthesis (? - ? days) |
| P-580764514 | 90 | As is | in stock |
| P-1275233801 | 90 | As is | in stock |
| P-580428802 | 95 | As is | by resynthesis (? - ? days) |
| P-579719465 | N/A | As is | by resynthesis (? - ? days) |
| P-905331276 | 97 | As is | 178 g |
| P-861947884 | 97 | As is | 1.73523 kg |
| P-863616238 | 96 | As is | by synthesis |
| P-579522102 | 90 | As is | 45 g |
| P-890210947 | 90 | As is | in stock |
| P-505536502 | 95 | As is | in stock |
| P-502466893 | 95 | As is | by synthesis |
| P-492238911 | 95 | As is | in stock |
| P-503002473 | 90 | As is | in stock |
| P-488550269 | 90 | As is | in stock |
| P-13751414 | 92 | As is | 300 mg |
| P-454398943 | 95 | As is | 3.122 g |
| P-454312341 | 95 | As is | 3.122 g |
| P-579623630 | 98 | As is | in stock |
| P-580513794 | 97 | As is | in stock |
| P-1272566521 | 97 | As is | 300 g |
| P-852386715 | 97 | As is | by synthesis |
| P-428014725 | 90 | As is | in stock |
| P-854741879 | 95 | As is | in stock |
| P-888859107 | N/A | As is | in stock |
| P-454368601 | 92 | As is | in stock |
| P-864677369 | 92 | As is | 300 mg |
| P-856063726 | 95 | As is | in stock |
| P-23852243 | 90 | As is | in stock |
| P-613814240 | 95 | As is | in stock |
| P-498716400 | 97 | As is | 2.5179 kg |
| P-502326348 | 90 | As is | in stock |
| P-22487999 | 90 | As is | 50 mg |
| P-1272896056 | 94 | As is | by resynthesis (? - ? days) |
| P-906775398 | 97 | As is | by synthesis |
| P-611473024 | 90 | As is | in stock |
| P-3248324 | 90 | As is | 3.103 g |
| P-480947706 | 97 | As is | in stock |
| P-870988308 | 90 | As a main component | 737 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 126.113 |
| logP | 0.1183 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 55.12 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 30.4483 |
| Atoms | 15 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 6 |
| 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 |

