Cas no 78208-58-9 (1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro-)
1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro-, is a nitro-substituted pyrazole derivative with a carboxamide functional group. This compound is of interest in synthetic and medicinal chemistry due to its structural features, which include a nitro group at the 4-position and dimethyl substitution at the 1- and 3-positions. The presence of these functional groups enhances its reactivity, making it a valuable intermediate for the synthesis of more complex heterocyclic compounds. Its well-defined molecular structure allows for precise modifications, facilitating applications in pharmaceutical research and agrochemical development. The compound’s stability and solubility properties further support its utility in laboratory-scale reactions and industrial processes.
78208-58-9 structure
Product Name:1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro-
CAS No:78208-58-9
MF:C6H8N4O3
MW:184.152720451355
CID:534864
PubChem ID:1229764
Update Time:2025-06-07
1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro-
- 1,3-DIMETHYL-4-NITRO-1H-PYRAZOLE-5-CARBOXAMIDE
- 2,5-dimethyl-4-nitropyrazole-3-carboxamide
- HMS565H21
- 4-nitro-1,3-dimethyl-1H-pyrazole-5-carboxamide
- 1,3-dimethyl-4-nitro-pyrazole-5-carboxamide
- MFCD00662667
- DTXSID30361191
- SCHEMBL1608919
- 1,3-dimethyl-4-nitropyrazole-5-carboxamide
- JZIBSZJXVQEBEU-UHFFFAOYSA-N
- AK-968/41169401
- AKOS003726173
- Maybridge1_008447
- 1,3-Dimethyl-4-nitro-5-pyrazolecarboxamide
- AB06653
- 78208-58-9
- 2,5-Dimethyl-4-nitro-2H-pyrazole-3-carboxylic acid amide
- EN300-7547295
-
- Inchi： 1S/C6H8N4O3/c1-3-4(10(12)13)5(6(7)11)9(2)8-3/h1-2H3,(H2,7,11)
- InChI Key： JZIBSZJXVQEBEU-UHFFFAOYSA-N
- SMILES： O=C(C1=C(C(C)=NN1C)[N+](=O)[O-])N
Computed Properties
- Exact Mass: 184.05964013g/mol
- Monoisotopic Mass: 184.05964013g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 239
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.3
- Topological Polar Surface Area: 107?2
1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-7547295-0.05g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 0.05g |
$212.0 | 2025-03-22 | |
| Enamine | EN300-7547295-0.1g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 0.1g |
$317.0 | 2025-03-22 | |
| Enamine | EN300-7547295-0.25g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 0.25g |
$452.0 | 2025-03-22 | |
| Enamine | EN300-7547295-0.5g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 0.5g |
$713.0 | 2025-03-22 | |
| Enamine | EN300-7547295-1.0g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 1.0g |
$914.0 | 2025-03-22 | |
| Enamine | EN300-7547295-2.5g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 2.5g |
$1791.0 | 2025-03-22 | |
| Enamine | EN300-7547295-5.0g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 5.0g |
$2650.0 | 2025-03-22 | |
| Enamine | EN300-7547295-10.0g |
1,3-dimethyl-4-nitro-1H-pyrazole-5-carboxamide |
78208-58-9 | 95.0% | 10.0g |
$3929.0 | 2025-03-22 | |
| A2B Chem LLC | AE03451-50mg |
1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro- |
78208-58-9 | 95% | 50mg |
$259.00 | 2024-04-19 | |
| A2B Chem LLC | AE03451-100mg |
1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro- |
78208-58-9 | 95% | 100mg |
$369.00 | 2024-04-19 |
1H-Pyrazole-5-carboxamide, 1,3-dimethyl-4-nitro- Related Literature
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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