Cas no 1228530-93-5 (3-(4-Fluorophenyl)-6-methylpicolinic acid)
1228530-93-5 structure
Product Name:3-(4-Fluorophenyl)-6-methylpicolinic acid
CAS No:1228530-93-5
MF:C13H10FNO2
MW:231.222406864166
CID:2122577
Update Time:2023-08-04
3-(4-Fluorophenyl)-6-methylpicolinic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-fluorophenyl)-6-methylpicolinic acid
- OIRJUSUBTCKWGI-UHFFFAOYSA-N
- 3-(4-Fluorophenyl)-6-methylpicolinic acid
-
- Inchi： 1S/C13H10FNO2/c1-8-2-7-11(12(15-8)13(16)17)9-3-5-10(14)6-4-9/h2-7H,1H3,(H,16,17)
- InChI Key： OIRJUSUBTCKWGI-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)C1=CC=C(C)N=C1C(=O)O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 277
- Topological Polar Surface Area: 50.2
3-(4-Fluorophenyl)-6-methylpicolinic acid Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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