Cas no 920019-75-6 (1H-Indazole-3-carboxylic acid, 1-(4-pyridinylmethyl)-)
920019-75-6 structure
Product Name:1H-Indazole-3-carboxylic acid, 1-(4-pyridinylmethyl)-
CAS No:920019-75-6
MF:C14H11N3O2
MW:253.256042718887
CID:759624
PubChem ID:58796803
Update Time:2025-04-19
1H-Indazole-3-carboxylic acid, 1-(4-pyridinylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazole-3-carboxylic acid, 1-(4-pyridinylmethyl)-
- 1-(pyridin-4-ylmethyl)indazole-3-carboxylic acid
- DTXSID10730205
- AKOS012406494
- 1-(Pyridin-4-ylmethyl)-1H-indazole-3-carboxylic acid
- 920019-75-6
- 1-[(Pyridin-4-yl)methyl]-1H-indazole-3-carboxylic acid
- SCHEMBL14584219
-
- Inchi： 1S/C14H11N3O2/c18-14(19)13-11-3-1-2-4-12(11)17(16-13)9-10-5-7-15-8-6-10/h1-8H,9H2,(H,18,19)
- InChI Key： HBLOOMHNDXSVRT-UHFFFAOYSA-N
- SMILES： OC(C1C2C=CC=CC=2N(CC2C=CN=CC=2)N=1)=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: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 331
- 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: 68?2
1H-Indazole-3-carboxylic acid, 1-(4-pyridinylmethyl)- Related Literature
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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