Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate
TL;DR: Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate (CAS 141807-55-8) is a chemical compound with molecular formula C11H10BrNO3 and molecular weight 282.9844 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-(2-bromo-6-oxo-1-prop-2-ynyl-4-pyridinyl)acetate
Also Known As: starbld0002582, methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate, Methyl 6-Bromo-1,2-dihydro-2-oxo-1-(2-propynyl)-4-pyridineacetate (85:15% Bromo:Chloro Derivative), Methyl 2-(2-bromo-6-oxo-1-prop-2-ynyl-pyridin-4-yl)acetate, Methyl 2-(6-bromo-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydropyridin-4-yl)acetate
Technical Specifications
| Molecular Formula | C11H10BrNO3 |
| Molecular Weight | 282.9844 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.9844 Da |
| Heavy Atoms | 16 |
| Complexity | 428.0 |
| SMILES | COC(=O)CC1=CC(=O)N(C(=C1)Br)CC#C |
| InChIKey | WXPGFDMZILDKJB-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate
Property Insights of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate. With a topological polar surface area (TPSA) of 46.6 Ų, Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate?
The CAS number of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate is 141807-55-8.
What is the molecular formula of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate?
The molecular formula of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate is C11H10BrNO3.
What is the molecular weight of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate?
The molecular weight of Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate is 282.9844 g/mol.
Where can I buy Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate?
You can request a quote for Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-(2-bromo-6-oxo-1-prop-2-ynylpyridin-4-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.