4-[3-(ethoxycarbonyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid
Structure Info
- Chemspace ID
- CSSB00020595838 (In-Stock Building Blocks)
- MFCD
- MFCD12027270
- IUPAC Name
- 4-[3-(ethoxycarbonyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid
- Mol formula
- C16H17NO4
- Mol weight
- 287 Da
- Catalog Number(s)
- 038055, AA00J5YB, AG242008, AGN-PC-0S61OL, AGNPC-0S61OL, AI94079, ALBB-006801, AVA72832, BB01-4492, BD506647, CD11115593, CS-0360054, CSC020595838, E021445, FE117626, H24240, HY-W297106, JH884252, LN00142467, LS-02444, ST00J7HV, TX00J76R, Y4195437, Y6376371
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.35
- Heavy atoms count
- 21
- Rotatable bond count
- 5
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.25
- Polar surface area (Å)
- 69
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of 4-[3-(ethoxycarbonyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoic acid (C16H17NO4) - CSSB00020595838](/st/structure/200/5cf9ce3f1bd0353f033a5955fe5d34fd/CCOC%2528%253DO%2529C1%253DC%2528C%2529N%2528C%2528C%2529%253DC1%2529C1%253DCC%253DC%2528C%253DC1%2529C%2528O%2529%253DO.png "C16H17NO4")
- Zoom the structure
- CSSB00020595838
Items Overall 5 items from 1 supplier
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| 1st Scientific LLC | 14 days | United States To: | 95 | 500 mg | 495.00 | |
| 1st Scientific LLC | 14 days | United States To: | 95 | 1 g | 536.80 | |
| 1st Scientific LLC | 14 days | United States To: | 95 | 5 g | 1,017.50 | |
| 1st Scientific LLC | 14 days | United States To: | 95 | 10 g | 1,430.00 | |
| 1st Scientific LLC | 14 days | United States To: | 95 | 25 g | 2,392.50 | |
Description: 4-[3-(Ethoxycarbonyl)-2,5-dimethyl-1h-pyrrol-1-yl]benzoic acid; CAS: 500728-32-5 | ||||||
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