1513-65-1
1513-65-1
Chemical Structure
2,6-Difluoropyridine
- CAS No.: 1513-65-1
- Formula:C5H3F2N
- Molecular Weight:115.08
IUPAC Name: 2,6-difluoropyridine
InChIKey: MBTGBRYMJKYYOE-UHFFFAOYSA-N
SMILES: FC1=CC=CC(F)=N1
Biological Activity: 2,6-Difluoropyridine is a fluorinated pyridine derivative. 2,6-Difluoropyridine adopts a planar conformation in its S0 electronic ground state and S1(π,π) excited state[1][2].
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2,6-Difluoropyridine | 99.98% | 2,6-Difluoropyridine is a fluorinated pyridine derivative. 2,6-Difluoropyridine adopts a planar conformation in its S0 electronic ground state and S1(π,π) excited state. | ||||||||||||||||||||
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Structural Analogs
-
Similarity Score 0.85
HY-W0031622-Amino-6-fluoropyridine -
Similarity Score 0.79
HY-W0075312-Fluoro-5-iodopyridine -
Similarity Score 0.78
HY-327465-Bromo-2-fluoropyridine -
Similarity Score 0.78
HY-652545-Amino-2-fluoropyridine -
Similarity Score 0.76
HY-327424-Bromo-2-fluoropyridine -
Similarity Score 0.75
HY-W018755R3,4-Difluoroaniline (Standard) -
Similarity Score 0.75
HY-795412-Bromo-1,4-difluorobenzene -
Similarity Score 0.75
HY-327482-Bromo-5-fluoropyridine -
Similarity Score 0.75
HY-591622,6-Dibromopyridine -
Explore the MedChemAI to find more analogs
References
- [1]. Sheu HL, et al. Infrared, Raman, and ultraviolet absorption spectra and theoretical calculations and structure of 2,6-difluoropyridine in its ground and excited electronic states. J Phys Chem A. 2013;117(50):13596-13604. [Content Brief]
- [2]. Baiardi A, et al. Vibrationally resolved NEXAFS at C and N K-edges of pyridine, 2-fluoropyridine and 2,6-difluoropyridine: A combined experimental and theoretical assessment. J Chem Phys. 2015 Nov 28;143(20):204102. [Content Brief]
