5-Amino-3-bromo-2-methylpyridine - CAS 186593-43-1
Catalog: |
BB014350 |
Product Name: |
5-Amino-3-bromo-2-methylpyridine |
CAS: |
186593-43-1 |
Synonyms: |
5-bromo-6-methyl-3-pyridinamine; 5-bromo-6-methylpyridin-3-amine |
IUPAC Name: | 5-bromo-6-methylpyridin-3-amine |
Description: | 5-Amino-3-bromo-2-methylpyridine (CAS# 186593-43-1) is a versatile reactant used in different synthetic preparations. It was used in the synthesis of amino acids by asymmetric enzymic transamination of keto acids in presence of axially chiral pyridoxamines as catalysts. |
Molecular Weight: | 187.04 |
Molecular Formula: | C6H7BrN2 |
Canonical SMILES: | CC1=C(C=C(C=N1)N)Br |
InChI: | InChI=1S/C6H7BrN2/c1-4-6(7)2-5(8)3-9-4/h2-3H,8H2,1H3 |
InChI Key: | UCLLYIVDXZGQSZ-UHFFFAOYSA-N |
Boiling Point: | 281.3 °C at 760 mmHg |
Density: | 1.593 g/cm3 |
MDL: | MFCD08060462 |
LogP: | 2.31590 |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021062245-A1 | Pyridone compounds and methods of use in the modulation of a protein kinase | 20190926 |
US-2020347052-A1 | Inhibitors of raf kinases | 20190503 |
WO-2020227020-A1 | Inhibitors of raf kinases | 20190503 |
US-10927111-B2 | Inhibitors of RAF kinases | 20190503 |
TW-202106684-A | Inhibitors of raf kinases | 20190503 |
Complexity: | 97.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.97926 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.97926 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 38.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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Amines and Anilines
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