Cas no 23723-27-5 (3-Pyridinecarboxylicacid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester)
23723-27-5 structure
Product Name:3-Pyridinecarboxylicacid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester
CAS No:23723-27-5
MF:C12H8F2N2O2
MW:250.200929641724
CID:256932
PubChem ID:211894
Update Time:2025-04-19
3-Pyridinecarboxylicacid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Pyridinecarboxylicacid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester
- (5-fluoropyridin-3-yl)methyl 5-fluoropyridine-3-carboxylate
- (5-Fluoro-3-pyridinyl)methyl 5-fluoro-3-pyridinecarboxylate
- BRN 0484901
- 3-Pyridinecarboxylic acid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester
- (5-Fluoro-3-pyridinyl)methyl 5-fluoronicotinate
- 3-Pyridinemethanol, 5-fluoro-, 5-fluoronicotinate
- 23723-27-5
- DTXSID50178389
-
- Inchi： 1S/C12H8F2N2O2/c13-10-1-8(3-15-5-10)7-18-12(17)9-2-11(14)6-16-4-9/h1-6H,7H2
- InChI Key： ZIVVDWHYYSISKS-UHFFFAOYSA-N
- SMILES： FC1=CN=CC(=C1)COC(C1C=NC=C(C=1)F)=O
Computed Properties
- Exact Mass: 250.05544
- Monoisotopic Mass: 250.05538383g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 291
- 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: 1.3
- Topological Polar Surface Area: 52.1?2
Experimental Properties
- PSA: 52.08
3-Pyridinecarboxylicacid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
23723-27-5 (3-Pyridinecarboxylicacid, 5-fluoro-, (5-fluoro-3-pyridinyl)methyl ester) Related Products
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