Methyl cyclopropanecarboxylate
TL;DR: Methyl cyclopropanecarboxylate (CAS 2868-37-3) is a chemical compound with molecular formula C5H8O2 and molecular weight 100.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl cyclopropanecarboxylate
Also Known As: Methyl cyclopropanecarboxylate, Methylcyclopropanecarboxylate, Methyl cyclopropane carboxylate, Cyclopropanecarboxylic acid, methyl ester, Methyl cyclopropylcarboxylate
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H8O2 |
| Molecular Weight | 100.05243 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 100.05243 Da |
| Heavy Atoms | 7 |
| Complexity | 84.0 |
| SMILES | COC(=O)C1CC1 |
| InChIKey | PKAHQJNJPDVTDP-UHFFFAOYSA-N |
Chemical Property Profile of Methyl cyclopropanecarboxylate
Property Insights of Methyl cyclopropanecarboxylate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl cyclopropanecarboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl cyclopropanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl cyclopropanecarboxylate has 0 hydrogen bond donor(s) and 2 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 cyclopropanecarboxylate?
The CAS number of Methyl cyclopropanecarboxylate is 2868-37-3.
What is the molecular formula of Methyl cyclopropanecarboxylate?
The molecular formula of Methyl cyclopropanecarboxylate is C5H8O2.
What is the molecular weight of Methyl cyclopropanecarboxylate?
The molecular weight of Methyl cyclopropanecarboxylate is 100.05243 g/mol.
Where can I buy Methyl cyclopropanecarboxylate?
You can request a quote for Methyl cyclopropanecarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl cyclopropanecarboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl cyclopropanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.