Cas no 1225462-73-6 (5-(2-fluoro-4-methylphenyl)pyridine-3-carboxylic acid)
1225462-73-6 structure
Product Name:5-(2-fluoro-4-methylphenyl)pyridine-3-carboxylic acid
CAS No:1225462-73-6
MF:C13H10FNO2
MW:231.222406864166
CID:2618002
PubChem ID:53222800
Update Time:2025-04-21
5-(2-fluoro-4-methylphenyl)pyridine-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 5-(2-fluoro-4-methylphenyl)pyridine-3-carboxylic acid
- A1-66933
- DTXSID20687150
- MFCD18316974
- SCHEMBL2262047
- 1225462-73-6
- WLEBYOMCBZOIBV-UHFFFAOYSA-N
- 5-(2-FLUORO-4-METHYLPHENYL)NICOTINIC ACID
- 5-(2-Fluoro-4-methylphenyl)nicotinic acid, 95%
-
- Inchi： 1S/C13H10FNO2/c1-8-2-3-11(12(14)4-8)9-5-10(13(16)17)7-15-6-9/h2-7H,1H3,(H,16,17)
- InChI Key： WLEBYOMCBZOIBV-UHFFFAOYSA-N
- SMILES： FC1C=C(C)C=CC=1C1C=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-(2-fluoro-4-methylphenyl)pyridine-3-carboxylic acid Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
1225462-73-6 (5-(2-fluoro-4-methylphenyl)pyridine-3-carboxylic acid) Related Products
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