Cas no 1192988-08-1 (5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid)
1192988-08-1 structure
Product Name:5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid
CAS No:1192988-08-1
MF:C13H10FNO2
MW:231.222406864166
CID:2616251
PubChem ID:53211425
Update Time:2025-04-21
5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid
- 1192988-08-1
- 5-(4-FLUORO-3-METHYLPHENYL)NICOTINIC ACID
- DTXSID00681358
- MFCD16200858
- AKOS005978376
- 5-(4-Fluoro-3-methylphenyl)nicotinic acid, 95%
-
- Inchi： 1S/C13H10FNO2/c1-8-4-9(2-3-12(8)14)10-5-11(13(16)17)7-15-6-10/h2-7H,1H3,(H,16,17)
- InChI Key： YGNMWTAFTOGZQP-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1C)C1C=NC=C(C(=O)O)C=1
Computed Properties
- Exact Mass: 231.06955672Da
- Monoisotopic Mass: 231.06955672Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 285
- 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: 2.5
- Topological Polar Surface Area: 50.2?2
5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
1192988-08-1 (5-(4-fluoro-3-methylphenyl)pyridine-3-carboxylic acid) Related Products
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