| CAS Number | 1049706-73-1 |
| Catalog Number | AG008ZAV(AGN-PC-0WNNRO) |
| Chemical Name | 3-Bromo-2-chloro-4-methyl-5-nitropyridine |
| IUPAC Name | 3-bromo-2-chloro-4-methyl-5-nitropyridine |
| InChI | InChI=1S/C6H4BrClN2O2/c1-3-4(10(11)12)2-9-6(8)5(3)7/h2H,1H3 |
| InChI Key | QGEFBUJRBVNTFX-UHFFFAOYSA-N |
| MDL Number | MFCD12024452 |
| Molecular Formula | C6H4BrClN2O2 |
| Molecular Weight | 251.4652 |
| SMILES | O=[N+](C1=CN=C(Cl)C(Br)=C1C)[O-] |
| Synonyms | 3-bromo-2-chloro-4-methyl-5-nitropyridine,
1049706-73-1,
3-Bromo-2-chloro-4-methyl-5-nitro-pyridine,
SCHEMBL109594,
CTK8C6576,
DTXSID80653952,
QGEFBUJRBVNTFX-UHFFFAOYSA-N,
MFCD12024452,
ZINC32914815,
AKOS015842221,
NE48665,
RD-0176,
AJ-85644,
DB-059231,
TC-063238,
FT-0652025,
3-bromanyl-2-chloranyl-4-methyl-5-nitro-pyridine,
A801120,
J-511844,
S02-0065,
Z1982490464,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.914g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.464g/mol |
| Monoisotopic Mass | 249.914g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 58.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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