Methyl 4-(hexyloxy)benzoate
Structure Info
- Chemspace ID
- CSSB00000246906 (In-Stock Building Blocks)
- CAS
- 50822-54-3
- MFCD
- MFCD00070803, MFCD00070803
- IUPAC Name
- methyl 4-(hexyloxy)benzoate
- Mol formula
- C14H20O3
- Mol weight
- 236 Da
- Catalog Number(s)
- 50822-54-3, A124768, ACM50822543, ArZ-UP520439, BB0286891, BBLS00000246906, BBV-40332234, CSC000246906, CSCR00008472715, EN300-13309854, IBS-L0053353, JH315495, OSSK_629487, STL065416, TX00DI11, Z15838979, ZX-RC058564, bbls00000246906, m34____34810____9139750, s_1458_470924_483916, s_1458____470924____483916
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.03
- Heavy atoms count
- 17
- Rotatable bond count
- 8
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.5
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00000246906
Items Overall 8 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 455.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 477.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 498.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 519.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 541.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 1,063.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 1,572.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 2,331.00 |
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Substructure Analogs
![Chemical structure of methyl 4-[(5-cyanopentyl)oxy]benzoate - CSSB00038519008](/st/structure/200/2ecbef0135092df1470fd1945ec62cdd/COC%2528%253DO%2529C1%253DCC%253DC%2528OCCCCCC%2523N%2529C%253DC1.png)
![Chemical structure of methyl 4-[(6-bromohexyl)oxy]benzoate - CSSB02502098426](/st/structure/200/d8d199405024a04d85bc179bed87b8c3/COC%2528%253DO%2529C1%253DCC%253DC%2528OCCCCCCBr%2529C%253DC1.png)
Similarity Analogs
![Chemical structure of methyl 4'-(hexyloxy)-[1,1'-biphenyl]-4-carboxylate - CSSB06581006426](/st/structure/200/efd40b4199ccf315cd3dd4c5d73423f0/CCCCCCOC1%253DCC%253DC%2528C2%253DCC%253DC%2528C%2528%253DO%2529OC%2529C%253DC2%2529C%253DC1.png)
![Chemical structure of methyl 4-({6-[4-(methoxycarbonyl)phenoxy]hexyl}oxy)benzoate - CSSB00025732737](/st/structure/200/5a022a66304bbf50a1ef478f8403b782/COC%2528%253DO%2529C1%253DCC%253DC%2528OCCCCCCOC2%253DCC%253DC%2528C%253DC2%2529C%2528%253DO%2529OC%2529C%253DC1.png)
