Cas no 101420-96-6 (1H-Indazole, 5-chloro-4-nitro-)
101420-96-6 structure
Product Name:1H-Indazole, 5-chloro-4-nitro-
CAS No:101420-96-6
MF:C7H4ClN3O2
MW:197.578559875488
CID:1129386
PubChem ID:17989268
Update Time:2025-04-20
1H-Indazole, 5-chloro-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazole, 5-chloro-4-nitro-
- 4-nitro-5-chloroindazole
- 5-chloro-4-nitro-1H-indazole
- DTXSID60591989
- AKOS028114168
- SCHEMBL2004512
- 101420-96-6
- DB-316689
- 1h-indazole,5-chloro-4-nitro-
- JIPHMTNGMPSQHL-UHFFFAOYSA-N
-
- Inchi： 1S/C7H4ClN3O2/c8-5-1-2-6-4(3-9-10-6)7(5)11(12)13/h1-3H,(H,9,10)
- InChI Key： JIPHMTNGMPSQHL-UHFFFAOYSA-N
- SMILES： ClC1C=CC2=C(C=NN2)C=1[N+](=O)[O-]
Computed Properties
- Exact Mass: 196.99932
- Monoisotopic Mass: 196.9992041g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 220
- 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: 2
- Topological Polar Surface Area: 74.5?2
Experimental Properties
- PSA: 71.82
- LogP: 2.64770
1H-Indazole, 5-chloro-4-nitro- Related Literature
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
101420-96-6 (1H-Indazole, 5-chloro-4-nitro-) Related Products
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