Methyl 4-(pyrimidin-2-yloxy)benzoate
TL;DR: Methyl 4-(pyrimidin-2-yloxy)benzoate (CAS 1090587-89-5) is a chemical compound with molecular formula C12H10N2O3 and molecular weight 230.06914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-pyrimidin-2-yloxybenzoate
Also Known As: Methyl 4-(pyrimidin-2-yloxy)benzoate, methyl 4-pyrimidin-2-yloxybenzoate, Methyl4-(pyrimidin-2-yloxy)benzoate, 4-(Pyrimidin-2-yloxy)benzoic acid methyl ester, Methyl 4-[(pyrimidin-2-yl)oxy]benzoate
Technical Specifications
| Molecular Formula | C12H10N2O3 |
| Molecular Weight | 230.06914 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 61.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.06914 Da |
| Heavy Atoms | 17 |
| Complexity | 246.0 |
| SMILES | COC(=O)C1=CC=C(C=C1)OC2=NC=CC=N2 |
| InChIKey | QPLXGVPDVXGPLS-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-(pyrimidin-2-yloxy)benzoate
Property Insights of Methyl 4-(pyrimidin-2-yloxy)benzoate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(pyrimidin-2-yloxy)benzoate. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(pyrimidin-2-yloxy)benzoate. Following Lipinski's Rule of Five, Methyl 4-(pyrimidin-2-yloxy)benzoate has 0 hydrogen bond donor(s) and 5 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 4-(pyrimidin-2-yloxy)benzoate?
The CAS number of Methyl 4-(pyrimidin-2-yloxy)benzoate is 1090587-89-5.
What is the molecular formula of Methyl 4-(pyrimidin-2-yloxy)benzoate?
The molecular formula of Methyl 4-(pyrimidin-2-yloxy)benzoate is C12H10N2O3.
What is the molecular weight of Methyl 4-(pyrimidin-2-yloxy)benzoate?
The molecular weight of Methyl 4-(pyrimidin-2-yloxy)benzoate is 230.06914 g/mol.
Where can I buy Methyl 4-(pyrimidin-2-yloxy)benzoate?
You can request a quote for Methyl 4-(pyrimidin-2-yloxy)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-(pyrimidin-2-yloxy)benzoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-(pyrimidin-2-yloxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.