| CAS Number | 1206249-86-6 |
| Catalog Number | AG008Z2L(AGN-PC-09TPG0) |
| Chemical Name | Methyl 4-bromo-6-chloropicolinate |
| IUPAC Name | methyl 4-bromo-6-chloropyridine-2-carboxylate |
| InChI | InChI=1S/C7H5BrClNO2/c1-12-7(11)5-2-4(8)3-6(9)10-5/h2-3H,1H3 |
| InChI Key | KTRAVYREWCQENZ-UHFFFAOYSA-N |
| MDL Number | MFCD14582021 |
| Molecular Formula | C7H5BrClNO2 |
| Molecular Weight | 250.4771 |
| SMILES | O=C(OC)C1=NC(Cl)=CC(Br)=C1 |
| Synonyms | methyl 4-bromo-6-chloropicolinate,
1206249-86-6,
methyl 4-bromo-6-chloropyridine-2-carboxylate,
4-bromo-6-chloro-2-pyridinecarboxylic acid methyl ester,
DTXSID00704399,
BCP06222,
ZINC71250722,
AKOS022173447,
QC-11652,
SC-50658,
AJ-117601,
AM20050709,
FT-0688631,
2-Pyridinecarboxylic acid, 4-bromo-6-chloro-,methyl ester,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.919g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.476g/mol |
| Monoisotopic Mass | 248.919g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number