Cas no 1261912-01-9 (4-(2,5-Difluorophenyl)pyridine-3-carboxylic acid)
1261912-01-9 structure
Product Name:4-(2,5-Difluorophenyl)pyridine-3-carboxylic acid
CAS No:1261912-01-9
MF:C12H7F2NO2
MW:235.186290025711
CID:2762989
PubChem ID:53229289
Update Time:2025-04-21
4-(2,5-Difluorophenyl)pyridine-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 1261912-01-9
- MFCD18323448
- 4-(2,5-DIFLUOROPHENYL)NICOTINIC ACID
- DTXSID20692522
- 4-(2,5-Difluorophenyl)pyridine-3-carboxylic acid
-
- Inchi： 1S/C12H7F2NO2/c13-7-1-2-11(14)9(5-7)8-3-4-15-6-10(8)12(16)17/h1-6H,(H,16,17)
- InChI Key： UXJDCMRPQRYFJR-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1C1C=CN=CC=1C(=O)O)F
Computed Properties
- Exact Mass: 235.04448479Da
- Monoisotopic Mass: 235.04448479Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 288
- 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: 2.2
- Topological Polar Surface Area: 50.2?2
4-(2,5-Difluorophenyl)pyridine-3-carboxylic acid Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
1261912-01-9 (4-(2,5-Difluorophenyl)pyridine-3-carboxylic acid) Related Products
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