Cas no 1227585-30-9 (2-chloro-4-(chloromethyl)-5-fluoropyridine)
1227585-30-9 structure
Product Name:2-chloro-4-(chloromethyl)-5-fluoropyridine
CAS No:1227585-30-9
MF:C6H4Cl2FN
MW:180.007062911987
CID:2618192
PubChem ID:72212822
Update Time:2025-04-21
2-chloro-4-(chloromethyl)-5-fluoropyridine Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-4-(chloromethyl)-5-fluoropyridine
- 1227585-30-9
- AB70990
- 2-Chloro-4-chloroMethyl-5-fluoro-pyridine
-
- Inchi： 1S/C6H4Cl2FN/c7-2-4-1-6(8)10-3-5(4)9/h1,3H,2H2
- InChI Key： QFQIXNOJGQCCPS-UHFFFAOYSA-N
- SMILES： ClCC1C=C(N=CC=1F)Cl
Computed Properties
- Exact Mass: 178.9704827Da
- Monoisotopic Mass: 178.9704827Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 112
- 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: 2.3
- Topological Polar Surface Area: 12.9?2
2-chloro-4-(chloromethyl)-5-fluoropyridine Related Literature
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
1227585-30-9 (2-chloro-4-(chloromethyl)-5-fluoropyridine) Related Products
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