Cas no 1261903-71-2 (5-(2,5-Dimethylphenyl)-2-methoxynicotinic acid)
1261903-71-2 structure
Product Name:5-(2,5-Dimethylphenyl)-2-methoxynicotinic acid
CAS No:1261903-71-2
MF:C15H15NO3
MW:257.284504175186
CID:2762429
PubChem ID:53222687
Update Time:2025-04-21
5-(2,5-Dimethylphenyl)-2-methoxynicotinic acid Chemical and Physical Properties
Names and Identifiers
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- MFCD18316871
- 5-(2,5-Dimethylphenyl)-2-methoxynicotinic acid, 95%
- 1261903-71-2
- 5-(2,5-DIMETHYLPHENYL)-2-METHOXYNICOTINIC ACID
- DTXSID60687058
- 5-(2,5-Dimethylphenyl)-2-methoxynicotinic acid
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- Inchi： 1S/C15H15NO3/c1-9-4-5-10(2)12(6-9)11-7-13(15(17)18)14(19-3)16-8-11/h4-8H,1-3H3,(H,17,18)
- InChI Key： IXRJUMVULSIERH-UHFFFAOYSA-N
- SMILES： O(C)C1=C(C(=O)O)C=C(C=N1)C1C=C(C)C=CC=1C
Computed Properties
- Exact Mass: 257.10519334Da
- Monoisotopic Mass: 257.10519334Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 321
- 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
- Topological Polar Surface Area: 59.4?2
5-(2,5-Dimethylphenyl)-2-methoxynicotinic acid Related Literature
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1. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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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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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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