Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate
TL;DR: Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate (CAS 127861-30-7) is a chemical compound with molecular formula C7H7ClN2O3 and molecular weight 202.01453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-chloro-6-methoxypyrimidine-4-carboxylate
Also Known As: methyl 2-chloro-6-methoxypyrimidine-4-carboxylate, methyl2-chloro-6-methoxypyrimidine-4-carboxylate, 4-Pyrimidinecarboxylic acid, 2-chloro-6-methoxy-, methyl ester, methyl 2-chloro-6-methoxy-pyrimidine-4-carboxylate, 2-Chloro-6-methoxypyrimidine-4-carboxylic acid methyl ester
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H7ClN2O3 |
| Molecular Weight | 202.01453 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 61.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.01453 Da |
| Heavy Atoms | 13 |
| Complexity | 191.0 |
| SMILES | COC1=NC(=NC(=C1)C(=O)OC)Cl |
| InChIKey | OBFFZLIOVNLYIL-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate
Property Insights of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate. Following Lipinski's Rule of Five, Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate 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 2-chloro-6-methoxypyrimidine-4-carboxylate?
The CAS number of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate is 127861-30-7.
What is the molecular formula of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate?
The molecular formula of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate is C7H7ClN2O3.
What is the molecular weight of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate?
The molecular weight of Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate is 202.01453 g/mol.
Where can I buy Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate?
You can request a quote for Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-chloro-6-methoxypyrimidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.