| CAS Number | 1211542-21-0 |
| Catalog Number | AG009YCK(AGN-PC-0WNPJU) |
| Chemical Name | 3-Bromo-2-methyl-5-(trifluoromethyl)pyridine |
| IUPAC Name | 3-bromo-2-methyl-5-(trifluoromethyl)pyridine |
| InChI | InChI=1S/C7H5BrF3N/c1-4-6(8)2-5(3-12-4)7(9,10)11/h2-3H,1H3 |
| InChI Key | FZHZGEPNTQEZLC-UHFFFAOYSA-N |
| MDL Number | MFCD13193665 |
| Molecular Formula | C7H5BrF3N |
| Molecular Weight | 240.0205 |
| SMILES | FC(C1=CN=C(C)C(Br)=C1)(F)F |
| Synonyms | 3-Bromo-2-methyl-5-(trifluoromethyl)pyridine,
1211542-21-0,
SCHEMBL13865688,
ZINC95831019,
AKOS022175799,
NE58320,
AK-31788,
AJ-135158,
Pyridine, 3-bromo-2-methyl-5-(trifluoromethyl)-,
|
| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.956g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.023g/mol |
| Monoisotopic Mass | 238.956g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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\N
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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\N
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Certificate of Analysis
Lot Number