| CAS Number | 1016228-01-5 |
| Catalog Number | AG000505(AGN-PC-0WAJQZ) |
| Chemical Name | Ethanone, 1-(6-bromo-3-fluoro-2-pyridinyl)- |
| IUPAC Name | 1-(6-bromo-3-fluoropyridin-2-yl)ethanone |
| InChI | InChI=1S/C7H5BrFNO/c1-4(11)7-5(9)2-3-6(8)10-7/h2-3H,1H3 |
| InChI Key | MXBFVOYREPRONK-UHFFFAOYSA-N |
| MDL Number | MFCD18258632 |
| Molecular Formula | C7H5BrFNO |
| Molecular Weight | 218.0231 |
| SMILES | CC(C1=NC(Br)=CC=C1F)=O |
| Synonyms | 1016228-01-5,
1-(6-bromo-3-fluoropyridin-2-yl)ethanone,
1-(6-BROMO-3-FLUOROPYRIDIN-2-YL)ETHAN-1-ONE,
1-(6-BROMO-3-FLUORO-PYRIDIN-2-YL)-ETHANONE,
Ethanone, 1-(6-bromo-3-fluoro-2-pyridinyl)-,
1-(6-Bromo-3-fluoro-pyridin-2-yl)ethanone,
SCHEMBL1855234,
KS-00000LMB,
MXBFVOYREPRONK-UHFFFAOYSA-N,
MFCD18258632,
AKOS026744923,
ZINC117322271,
CS-W000628,
AK372267,
DS-13241,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.954g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.025g/mol |
| Monoisotopic Mass | 216.954g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number