Cyclopentyl 4-methoxybenzoate
TL;DR: Cyclopentyl 4-methoxybenzoate (CAS 10154-76-4) is a chemical compound with molecular formula C13H16O3 and molecular weight 220.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 4-methoxybenzoate
Also Known As: Cyclopentyl 4-methoxybenzoate, Cyclopentyl 4-methoxybenzoate #, 4-Methoxybenzoic acid, cyclopentyl ester, Benzoic acid,4-methoxy-, cyclopentyl ester
| Molecular Formula | C13H16O3 |
|---|---|
| Molecular Weight | 220.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.10994 |
| Heavy Atoms | 16 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 10154-76-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC2CCCC2 |
| InChIKey | XVHVFWLEKAAUSQ-UHFFFAOYSA-N |
Product Overview
Cyclopentyl 4-methoxybenzoate (CAS 10154-76-4), with molecular formula C13H16O3 and molecular weight 220.11 g/mol. IUPAC: cyclopentyl 4-methoxybenzoate.
Chemical Property Profile of Cyclopentyl 4-methoxybenzoate
Property Insights of Cyclopentyl 4-methoxybenzoate
The XLogP value of 3.0 indicates that Cyclopentyl 4-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Cyclopentyl 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentyl 4-methoxybenzoate 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
Frequently Asked Questions
What is the CAS number of Cyclopentyl 4-methoxybenzoate?
The CAS number of Cyclopentyl 4-methoxybenzoate is 10154-76-4.
What is the molecular formula of Cyclopentyl 4-methoxybenzoate?
The molecular formula of Cyclopentyl 4-methoxybenzoate is C13H16O3.
What is the molecular weight of Cyclopentyl 4-methoxybenzoate?
The molecular weight of Cyclopentyl 4-methoxybenzoate is 220.11 g/mol.
Where can I buy Cyclopentyl 4-methoxybenzoate?
You can request a quote for Cyclopentyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.