4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoic acid
Structure Info
- Chemspace ID
- CSSB00000026722 (In-Stock Building Blocks)
- CAS
- 842137-56-8
- MFCD
- MFCD09049757, MFCD09049757
- IUPAC Name
- 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoic acid
- Mol formula
- C11H8ClNO2S
- Mol weight
- 254 Da
- Catalog Number(s)
- A1107448, AGN-PC-015WKZ, AR019NQ3, AV29167, BBV-015051, BD01068264, BVV-820785510, C650768, CS-0248102, CSC000026722, D85546, D85546-0.1G, D85546-0.25G, EN300-39126, ST019OHV, TX019O6R, Y3187277, ZXC252403
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- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.98
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.09
- Polar surface area (Å)
- 50
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
![Chemical structure of 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoic acid (C11H8ClNO2S) - CSSB00000026722](/st/structure/200/166c7c6a2aa79b6eb1253a08e434cd52/OC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png "C11H8ClNO2S")
- Zoom the structure
- CSSB00000026722
Items Overall 26 items from 4 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 50 mg | 66.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 100 mg | 98.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 250 mg | 142.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 500 mg | 271.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 1 g | 371.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 2.5 g | 726.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 5 g | 1,074.00 | |
| Enamine Ltd. | 5 days | Ukraine To: | 95 | 10 g | 1,593.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 50 mg | 66.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 100 mg | 98.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 250 mg | 142.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 500 mg | 271.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 1 g | 371.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 2.5 g | 726.00 | |
| Enamine US, Inc. | 5 days | United States To: | 95 | 5 g | 1,074.00 | |
| UORSY | 5 days | Ukraine To: | 95 | 1 g | 371.00 | |
| UORSY | 5 days | Ukraine To: | 95 | 2.5 g | 726.00 | |
| UORSY | 5 days | Ukraine To: | 95 | 5 g | 1,075.00 | |
| UORSY | 5 days | Ukraine To: | 95 | 10 g | 1,593.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 129.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 167.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 217.80 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 367.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 1 g | 482.90 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 2.5 g | 894.30 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 5 g | 1,298.00 | |
Description: 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoic acid; CAS: 842137-56-8 | ||||||
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Substructure Analogs
![Chemical structure of methyl 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoate - CSSB00000747988](/st/structure/200/0a9367e8c3d2050e709b0c805f07a524/COC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png)
![Chemical structure of ethyl 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoate - CSSB20895628392](/st/structure/200/5a229d67b7c2c1e465155ce2e8edf32f/CCOC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png)
Similarity Analogs
![Chemical structure of 3-[4-(chloromethyl)-1,3-thiazol-2-yl]benzoic acid - CSSB00020790524](/st/structure/200/bb40983edf87a31027bc13bb22a3169c/OC%2528%253DO%2529C1%253DCC%253DCC%2528%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png)
![Chemical structure of 4-[4-(chloromethyl)-1,3-thiazol-2-yl]-N-methylbenzamide - CSSB00000319462](/st/structure/200/bc3f5e8870238de8be2f2dd97476015d/CNC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png)
![Chemical structure of 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzonitrile - CSSB00020963691](/st/structure/200/871e9fa2b90472726f84b413eee9aad8/ClCC1%253DCSC%2528%253DN1%2529C1%253DCC%253DC%2528C%253DC1%2529C%2523N.png)
![Chemical structure of 4-[4-(chloromethyl)-1,3-thiazol-2-yl]benzamide - CSSB00000744460](/st/structure/200/e5e3dcd1f8fa16f4a8a8d913ada5eff2/NC%2528%253DO%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png)
![Chemical structure of 4-(chloromethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole - CSSB00000286473](/st/structure/200/da91fd5ffe522d53445c20def15ef973/FC%2528F%2529%2528F%2529C1%253DCC%253DC%2528C%253DC1%2529C1%253DNC%2528CCl%2529%253DCS1.png)
![Chemical structure of 2-chloro-N-({2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)acetamide - CSSB02073511389](/st/structure/200/543673c5c81cdb376e6e3d4cd983fe00/O%253DC%2528CCl%2529NCC1%253DCSC%2528C2%253DCC%253DC%2528C%2528F%2529%2528F%2529F%2529C%253DC2%2529%253DN1.png)
