3-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}benzoic acid
Structure Info
- Chemspace ID
- CSSB00000258356 (In-Stock Building Blocks)
- CAS
- 1017046-67-1
- MFCD
- MFCD09941376, MFCD09941376
- IUPAC Name
- 3-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}benzoic acid
- Mol formula
- C12H12N2O2S
- Mol weight
- 248 Da
- Catalog Number(s)
- AA01A8ER, AG01A8HJ, AKOS000182665, AR01A96J, AV56975, BB4LS-EN300-61626, BBLS00000258356, BBV-077150, BD00877280, CS-0252796, CSC000258356, EN300-61626, G20232, HY-W192792, M323338, PB51172337, SQB04667, ST01A9YB, TX01A9N7, Y3215990, Z51094869, ZXC355614, bbls00000258356, m7____27107____93010
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.55
- Heavy atoms count
- 17
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.166
- Polar surface area (Å)
- 55
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSB00000258356
Items Overall 30 items from 5 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| BB4LS US | 2 days | United States To: | 95 | 50 umol | 28.13 | |
| BB4LS US | 2 days | United States To: | 95 | 100 umol | 39.63 | |
| BB4LS US | 2 days | United States To: | 95 | 200 umol | 53.00 | |
| BB4LS US | 2 days | United States To: | 95 | 300 umol | 71.00 | |
| BB4LS US | 2 days | United States To: | 95 | 500 umol | 91.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 53.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 83.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 116.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 218.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 314.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 614.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 908.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 53.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 83.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 116.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 218.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 314.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 614.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 50 umol | 28.13 | |
| BB4LS EU | 7 days | Germany To: | 95 | 100 umol | 39.63 | |
| BB4LS EU | 7 days | Germany To: | 95 | 200 umol | 53.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 300 umol | 71.00 | |
| BB4LS EU | 7 days | Germany To: | 95 | 500 umol | 91.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 114.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 149.60 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 188.10 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 305.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 416.90 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 2.5 g | 764.50 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 5 g | 1,104.40 | |
Description: 3-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}benzoic acid; CAS: 1017046-67-1 | ||||||
For a custom pack size or bulk
please drop us a line:Enquire
please drop us a line:Enquire



![Chemical structure of 3-[(1H-pyrazol-1-yl)methyl]benzoic acid - CSSB00000759125](/st/structure/200/aec20757530989726dc040fb42d3a37d/OC%2528%253DO%2529C1%253DCC%253DCC%2528CN2C%253DCC%253DN2%2529%253DC1.png)
![Chemical structure of 4-{2-[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetamido}benzoic acid - CSSB00000706303](/st/structure/200/54e59973923a79eb2c1319e83fcee1fd/CN1C%253DCN%253DC1SCC%2528%253DO%2529NC1%253DCC%253DC%2528C%253DC1%2529C%2528O%2529%253DO.png)
![Chemical structure of 3-[(thiophen-2-ylsulfanyl)methyl]benzoic acid - CSSB00000239321](/st/structure/200/af720e8b0441aa75a80127e30862c1e0/OC%2528%253DO%2529C1%253DCC%253DCC%2528CSC2%253DCC%253DCS2%2529%253DC1.png)
![Chemical structure of 3-[(2-methyl-1H-imidazol-1-yl)methyl]benzoic acid - CSSB00011223738](/st/structure/200/33592bbb973b91c7681c407d37bbd226/CC1%253DNC%253DCN1CC1%253DCC%253DCC%2528%253DC1%2529C%2528O%2529%253DO.png)
