Methyl 4-(pentyloxy)benzoate
Structure Info
- Chemspace ID
- CSSB00000148910 (In-Stock Building Blocks)
- CAS
- 5416-97-7
- MFCD
- MFCD00070802, MFCD00070802
- IUPAC Name
- methyl 4-(pentyloxy)benzoate
- Mol formula
- C13H18O3
- Mol weight
- 222 Da
- Catalog Number(s)
- 232849, 5416-97-7, A124773, ACM5416977, ArZ-UP520425, BB12-5332, BBLS00000148910, BBV-39823938, CSC000148910, CSCR00004028608, EN300-10522257, JH332779, Z18387021, ZX-RC058550, bbls00000148910, s_1458_473404_483916, s_1458____473404____483916
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.59
- Heavy atoms count
- 16
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.46153846153846
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB00000148910
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-hydroxypentyl)oxy]benzoate - CSSB00005925994](/st/structure/200/a8c499e13a621d4428efbb94d13efa6b/COC%2528%253DO%2529C1%253DCC%253DC%2528OCCCCCO%2529C%253DC1.png)
Similarity Analogs
![Chemical structure of methyl 4'-(pentyloxy)-[1,1'-biphenyl]-4-carboxylate - CSSB06585345377](/st/structure/200/360bc6d5b6f182c0473a23616f49a399/CCCCCOC1%253DCC%253DC%2528C2%253DCC%253DC%2528C%2528%253DO%2529OC%2529C%253DC2%2529C%253DC1.png)
