3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid
TL;DR: 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid (CAS 1098881-13-0) is a chemical compound with molecular formula C8H12O4 and molecular weight 172.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methoxycarbonylcyclopentane-1-carboxylic acid
Also Known As: 3-(methoxycarbonyl)cyclopentane-1-carboxylic acid, 3-methoxycarbonylcyclopentane-1-carboxylic acid, 2-Pyridone-6-carboxaldehyde, 1,3-Cyclopentanedicarboxylicacid, 1-methyl ester, 2-phenylthioethanamidine,chloride
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H12O4 |
| Molecular Weight | 172.07356 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 172.07356 Da |
| Heavy Atoms | 12 |
| Complexity | 199.0 |
| SMILES | COC(=O)C1CCC(C1)C(=O)O |
| InChIKey | FVUHGTQDOMGZOT-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid
Property Insights of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid. Following Lipinski's Rule of Five, 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid?
The CAS number of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid is 1098881-13-0.
What is the molecular formula of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid?
The molecular formula of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid is C8H12O4.
What is the molecular weight of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid?
The molecular weight of 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid is 172.07356 g/mol.
Where can I buy 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid?
You can request a quote for 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 3-(Methoxycarbonyl)cyclopentane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.