Cas no 1356087-63-2 (5-Nitro-3-(p-tolyl)-1H-indazole)
5-Nitro-3-(p-tolyl)-1H-indazole is a heterocyclic compound featuring an indazole core substituted with a nitro group at the 5-position and a p-tolyl group at the 3-position. This structure imparts unique electronic and steric properties, making it a valuable intermediate in medicinal chemistry and organic synthesis. The nitro group enhances reactivity, facilitating further functionalization, while the p-tolyl moiety contributes to stability and lipophilicity. Its well-defined molecular architecture is advantageous for designing pharmacophores, particularly in the development of kinase inhibitors and other bioactive molecules. The compound's high purity and consistent performance make it suitable for research applications requiring precise chemical modifications. Its crystalline form ensures ease of handling and storage under standard laboratory conditions.
1356087-63-2 structure
Product Name:5-Nitro-3-(p-tolyl)-1H-indazole
CAS No:1356087-63-2
MF:C14H11N3O2
MW:253.256042718887
CID:1033419
PubChem ID:71303800
Update Time:2025-07-02
5-Nitro-3-(p-tolyl)-1H-indazole Chemical and Physical Properties
Names and Identifiers
-
- 5-Nitro-3-(p-tolyl)-1H-indazole
- 3-(4-Methylphenyl)-5-nitro-1H-indazole
- 1356087-63-2
- DTXSID40745120
-
- Inchi: 1S/C14H11N3O2/c1-9-2-4-10(5-3-9)14-12-8-11(17(18)19)6-7-13(12)15-16-14/h2-8H,1H3,(H,15,16)
- InChI Key: YCJJVNDRVRGHPD-UHFFFAOYSA-N
- SMILES: [O-][N+](C1C=CC2=C(C=1)C(C1C=CC(C)=CC=1)=NN2)=O
Computed Properties
- Exact Mass: 253.085126602g/mol
- Monoisotopic Mass: 253.085126602g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 336
- 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: 3.4
- Topological Polar Surface Area: 74.5?2
5-Nitro-3-(p-tolyl)-1H-indazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM150329-1g |
5-nitro-3-(p-tolyl)-1H-indazole |
1356087-63-2 | 95% | 1g |
$*** | 2023-03-31 | |
| Chemenu | CM150329-1g |
5-nitro-3-(p-tolyl)-1H-indazole |
1356087-63-2 | 95% | 1g |
$893 | 2021-08-05 | |
| Alichem | A269001926-1g |
5-Nitro-3-(p-tolyl)-1H-indazole |
1356087-63-2 | 95% | 1g |
806.40 USD | 2021-06-01 |
5-Nitro-3-(p-tolyl)-1H-indazole Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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