![Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate structure](/static/products/1158/115851-73-5.webp)
Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate
TL;DR: Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate (CAS 115851-73-5) is a chemical compound with molecular formula C14H15ClO3 and molecular weight 266.07098 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate
Also Known As: Methyl 1-(4-chlorobenzyl)-2-oxocyclopentane-1-carboxylate, methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate, 1-[(4-Chlorophenyl)methyl]-2-oxocyclopentanecarboxylic Acid Methyl Ester, Methyl 1-(p-Chlorobenzyl)-2-oxocyclopentanecarboxylate, J1.628.398C
Technical Specifications
| Molecular Formula | C14H15ClO3 |
| Molecular Weight | 266.07098 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.07098 Da |
| Heavy Atoms | 18 |
| Complexity | 334.0 |
| SMILES | COC(=O)C1(CCCC1=O)CC2=CC=C(C=C2)Cl |
| InChIKey | XEFHZYULZFZBFU-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate
Property Insights of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate. With a topological polar surface area (TPSA) of 43.4 Ų, Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate 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 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate?
The CAS number of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate is 115851-73-5.
What is the molecular formula of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate?
The molecular formula of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate is C14H15ClO3.
What is the molecular weight of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate?
The molecular weight of Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate is 266.07098 g/mol.
Where can I buy Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate?
You can request a quote for Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate?
Yes, CoreyChem provides custom synthesis services for Methyl 1-[(4-chlorophenyl)methyl]-2-oxocyclopentane-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.