MCULE-3752198299
- 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 | 98 | 14 working days | Get Quote |
5 mg | 5 USD | 98 | 14 working days | Get Quote |
10 mg | 5 USD | 98 | 14 working days | Get Quote |
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MCULE-5672446896
- Component type: Main
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MCULE-2580081667
- Component type: Unknown
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MCULE-3394284504
- Component type: Unknown
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MCULE-4933227820
- Component type: Unknown
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MCULE-1471368384
- Component type: Unknown
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MCULE-8409992127
- Component type: Main
Name | File |
---|---|
SDF | MCULE-3752198299.sdf |
SMILES | MCULE-3752198299.smiles |
Standard InChI | MCULE-3752198299.inchi |
InChIKey | MCULE-3752198299.txt |
mcule product ID | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|
P-867565844 | N/A | As is | in stock |
P-875725543 | N/A | As is | in stock |
P-874617907 | 97 | As is | in stock |
P-903054482 | 98 | As is | 200 g |
P-893552888 | 90 | As is | 422.702 g |
P-1263079517 | N/A | As is | in stock |
P-868827063 | 97 | As is | 10 kg |
P-619855485 | 90 | As is | 20.585 g |
P-675052821 | 90 | As is | in stock |
P-903004453 | 98 | As is | in stock |
P-34459545 | 90 | As is | in stock |
P-580287077 | N/A | As is | by resynthesis (? - ? days) |
P-889300197 | 98 | As is | 1.462 g |
P-905325364 | 98 | As is | in stock |
P-870661661 | 99 | As is | in stock |
P-502947718 | 90 | As is | in stock |
P-488550994 | 90 | As is | in stock |
P-878215584 | 95 | As is | 1000 mg |
P-905476542 | 95 | As is | by resynthesis (? - ? days) |
P-904073816 | 95 | As is | in stock |
P-620068067 | 90 | As is | 1000 mg |
P-620223205 | 95 | As is | 1000 mg |
P-888885007 | N/A | As is | in stock |
P-454369236 | 92 | As is | in stock |
P-904100139 | 97 | As is | 85 g |
P-903957403 | 94 | As is | by resynthesis (? - ? days) |
P-611490835 | 90 | As is | in stock |
P-1144623 | 90 | As is | 3.491 g |
P-3229999 | 90 | As is | 3.491 g |
P-893947197 | 95 | As is | in stock |
P-867634059 | 95 | As a main component | in stock |
P-867402057 | N/A | As a main component | by synthesis |
P-875798892 | N/A | As a main component | in stock |
P-869194603 | 95 | As a main component | in stock |
P-505400527 | 98 | As a main component | in stock |
P-903153754 | 98 | As a main component | 250 g |
P-905492195 | 95 | As a main component | 10 g |
P-866098418 | 95 | As a main component | 270 g |
P-675245394 | N/A | As a main component | in stock |
P-851899024 | N/A | As a main component | by synthesis |
P-489181628 | 97 | As a main component | in stock |
P-865920544 | 98 | As a main component | 300 g |
P-494346808 | 95 | As a main component | 211.25 g |
P-896041940 | 95 | As a main component | by synthesis |
P-864130706 | 95 | As a main component | in stock |
P-674399752 | 97 | As a main component | by synthesis |
P-893258201 | 95 | As a main component | by synthesis |
P-617648816 | 90 | As a main component | in stock |
P-868593967 | 98 | As a main component | in stock |
P-862045256 | 95 | As a main component | 34.722 g |
P-905348071 | 95 | As a main component | 5 g |
P-900956925 | 95 | As a main component | in stock |
P-855993614 | 98 | As a main component | 100 mg |
P-524169526 | 98 | As a main component | 25 g |
P-580477196 | N/A | As a main component | by synthesis |
P-852500377 | N/A | As a main component | in stock |
P-519757134 | 95 | As a main component | 137.7 g |
P-428041288 | 95 | As a main component | 137.7 kg |
P-895284485 | 95 | As a main component | by synthesis |
P-855400559 | 95 | As a main component | in stock |
P-889867684 | 95 | As a main component | by synthesis |
P-502401641 | 90 | As a main component | in stock |
P-22472641 | 90 | As a main component | 100 mg |
P-611490802 | 90 | As a main component | in stock |
P-872756094 | 95 | As a main component | in stock |
P-867563581 | 97 | As a component | in stock |
P-867522889 | N/A | As a component | by synthesis |
P-875704023 | N/A | As a component | in stock |
P-875722763 | N/A | As a component | in stock |
P-869194345 | 95 | As a component | in stock |
P-615729689 | 95 | As a component | in stock |
P-505351934 | 98 | As a component | in stock |
P-903052073 | 98 | As a component | 50 kg |
P-903029246 | 98 | As a component | 18.5 kg |
P-905476954 | 95 | As a component | 1000 g |
P-905485712 | 95 | As a component | 100 g |
P-606870115 | N/A | As a component | in stock |
P-868963208 | N/A | As a component | in stock |
P-865904769 | 98 | As a component | 25 kg |
P-596928218 | 98 | As a component | 50 kg |
P-580195765 | 98 | As a component | in stock |
P-869393619 | 95 | As a component | in stock |
P-864203617 | 95 | As a component | in stock |
P-889739984 | 97 | As a component | 75 g |
P-869376396 | 98 | As a component | 2.625 kg |
P-666959283 | 97 | As a component | 4.935 kg |
P-890232788 | 95 | As a component | by synthesis |
P-893232986 | 95 | As a component | in stock |
P-580451404 | 98 | As a component | in stock |
P-868564364 | 95 | As a component | in stock |
P-868608590 | 97 | As a component | in stock |
P-580779022 | 90 | As a component | by resynthesis (? - ? days) |
P-580768223 | 90 | As a component | in stock |
P-905343049 | 95 | As a component | in stock |
P-901382258 | 95 | As a component | 99 g |
P-901411975 | 97 | As a component | 17.4217 kg |
P-905361210 | 97 | As a component | 1000 g |
P-505503636 | 95 | As a component | in stock |
P-856009821 | 95 | As a component | 100 mg |
P-855918484 | 97 | As a component | 1000 g |
P-871258728 | 95 | As a component | 5 kg |
P-31274762 | 90 | As a component | 10 g |
P-856040305 | 90 | As a component | 10 g |
P-31265771 | 90 | As a component | 500 mg |
P-613281202 | 95 | As a component | by synthesis |
P-580512159 | 95 | As a component | 830 g |
P-852426748 | N/A | As a component | in stock |
P-852511030 | N/A | As a component | in stock |
P-424432703 | 90 | As a component | 330 mg |
P-617711367 | 90 | As a component | 330 mg |
P-888885008 | N/A | As a component | in stock |
P-500375433 | 98 | As a component | by synthesis |
P-885532761 | 95 | As a component | by synthesis |
P-889883888 | 95 | As a component | by synthesis |
P-675092415 | 90 | As a component | in stock |
P-596783652 | 95 | As a component | 3.245 kg |
P-869127271 | 95 | As a component | by synthesis |
P-892291424 | 95 | As a component | 1.003 g |
P-888640425 | 95 | As a component | 1.003 g |
P-502385728 | 90 | As a component | in stock |
P-873223075 | 90 | As a component | in stock |
P-906783234 | 97 | As a component | by synthesis |
P-906782263 | 98 | As a component | by synthesis |
P-906779857 | 98 | As a component | by synthesis |
P-855298723 | 90 | As a component | in stock |
P-893987649 | 95 | As a component | in stock |
Property | Value |
---|---|
Components | 1 |
Mass | 90.150 |
logP | 1.0429 |
H-bond acceptors | 2 |
H-bond donors | 2 |
Rotatable bonds | 1 |
PSA | 75.17 |
RO5 violations | 0 |
RO3 violations | 1 |
Refractivity | 25.6171 |
Atoms | 11 |
Rings | 0 |
Heavy atoms | 5 |
Hydrogen atoms | 6 |
Heteroatoms | 3 |
N/O atoms | 2 |
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 | 0 |
Unknown stereo double bonds | 0 |
Undefined stereo double bonds | 1 |