Cas no 875577-66-5 (1H-Indazole-3-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)-)
![1H-Indazole-3-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)- structure](https://ossimg.kuujia.com/scimg/876000/875577-66-5x500.png)
875577-66-5 structure
Product Name:1H-Indazole-3-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)-
CAS No:875577-66-5
MF:C21H16N2O2
MW:328.363945007324
CID:655153
PubChem ID:11515406
Update Time:2025-04-19
1H-Indazole-3-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazole-3-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)-
- 1-[(4-phenylphenyl)methyl]indazole-3-carboxylic acid
- DTXSID50467907
- 875577-66-5
-
- Inchi： 1S/C21H16N2O2/c24-21(25)20-18-8-4-5-9-19(18)23(22-20)14-15-10-12-17(13-11-15)16-6-2-1-3-7-16/h1-13H,14H2,(H,24,25)
- InChI Key： NDLZXTTVQOLMMI-UHFFFAOYSA-N
- SMILES： OC(C1C2C=CC=CC=2N(CC2C=CC(C3C=CC=CC=3)=CC=2)N=1)=O
Computed Properties
- Exact Mass: 328.121177757g/mol
- Monoisotopic Mass: 328.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 25
- Rotatable Bond Count: 4
- Complexity: 455
- 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: 4.7
- Topological Polar Surface Area: 55.1?2
1H-Indazole-3-carboxylic acid, 1-([1,1'-biphenyl]-4-ylmethyl)- Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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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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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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