4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid
Structure Info
- Chemspace ID
- CSSB00000489564 (In-Stock Building Blocks)
- CAS
- 879465-94-8
- MFCD
- MFCD01114901
- IUPAC Name
- 4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid
- Mol formula
- C11H9N3O4
- Mol weight
- 247 Da
- Catalog Number(s)
- AA00JK70, AG166722, AGN-PC-0WB8MC, AJ12536, AK-968/37166225, AR00JKYS, B001203, BB042622, BB05-0411, BBLS00000489564, BBV-32465441, BD319206, CD11036754, CS-0262697, CSC000489564, EKB46594, EN300-83521, G54552, HY-W200026, IBS-E0139174, OSSL_082011, PB56946445, PBMR179033, ST00JLQK, STK346641, STOCK3S-31655, TX00JLFG, UZI/9098795, X30160, Y3158894, Z56868977, ZX-SK003402, ZXC295577, bbls00000489564, m270034____28351444____11624074
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.32
- Heavy atoms count
- 18
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.09
- Polar surface area (Å)
- 98
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 1
![Chemical structure of 4-[(3-nitro-1H-pyrazol-1-yl)methyl]benzoic acid (C11H9N3O4) - CSSB00000489564](/st/structure/200/d1290d6dec99183e331db279a21a5f8c/OC%2528%253DO%2529C1%253DCC%253DC%2528CN2C%253DCC%2528%253DN2%2529%255BN%252B%255D%2528%255BO-%255D%2529%253DO%2529C%253DC1.png "C11H9N3O4")
- Zoom the structure
- CSSB00000489564
Items Overall 19 items from 4 suppliers
| Supplier | Lead time | Ships from | Purity | Pack | Price, $ | Qty |
|---|---|---|---|---|---|---|
| Enamine US, Inc. | 2 days | United States To: | 95 | 50 mg | 72.00 | |
| Enamine US, Inc. | 2 days | United States To: | 95 | 100 mg | 108.00 | |
| Enamine US, Inc. | 2 days | United States To: | 95 | 250 mg | 154.00 | |
| Enamine US, Inc. | 2 days | United States To: | 95 | 500 mg | 243.00 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 50 mg | 136.40 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 100 mg | 178.20 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 250 mg | 232.10 | |
| 1st Scientific LLC | 7 days | United States To: | 95 | 500 mg | 334.40 | |
Description: 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid; CAS: 879465-94-8 | ||||||
| AA Blocks CN | 12 days | China To: | 90 | 10 mg | 345.40 | |
| AA Blocks CN | 12 days | China To: | 90 | 20 mg | 363.00 | |
| AA Blocks CN | 12 days | China To: | 90 | 50 mg | 399.30 | |
Description: 4-((3-Nitro-1H-pyrazol-1-yl)methyl)benzoic acid; CAS: 879465-94-8 | ||||||
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 50 mg | 72.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 100 mg | 108.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 250 mg | 154.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 500 mg | 243.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 1 g | 311.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 2.5 g | 475.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 5 g | 749.00 | |
| Enamine Ltd. | 15 days | Ukraine To: | 95 | 10 g | 1,092.00 | |
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