Methyl 5-Bromo-4-Chloronicotinate - CAS 1256808-62-4
Catalog: |
BB075925 |
Product Name: |
Methyl 5-Bromo-4-Chloronicotinate |
CAS: |
1256808-62-4 |
Synonyms: |
Methyl 5-Bromo-4-chloro-3-pyridinecarboxylate |
IUPAC Name: | methyl 5-bromo-4-chloropyridine-3-carboxylate |
Description: | Methyl 5-Bromo-4-Chloronicotinate is a useful research chemical. |
Molecular Weight: | 250.47 |
Molecular Formula: | C7H5NO2ClBr |
Canonical SMILES: | COC(=O)C1=CN=CC(=C1Cl)Br |
InChI: | InChI=1S/C7H5BrClNO2/c1-12-7(11)4-2-10-3-5(8)6(4)9/h2-3H,1H3 |
InChI Key: | WJJBNSODAKTWHI-UHFFFAOYSA-N |
Melting Point: | 65 - 67°C |
Solubility: | Chloroform (Slightly), Ethyl Acetate (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | -20°C |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.91922 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.91922 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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