Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester
TL;DR: Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester (CAS 4339-96-2) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate
Also Known As: 2-furilmonoxime, ChemDiv3_014874, 2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate, Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester, 2-(dimethylamino)ethyl 1-phenylcyclopentanecarboxylate
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 4339-96-2 |
|---|---|
| SMILES | CN(C)CCOC(=O)C1(CCCC1)C2=CC=CC=C2 |
| InChIKey | VZAZOXVEMAUMLH-UHFFFAOYSA-N |
Product Overview
Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester (CAS 4339-96-2), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: 2-(dimethylamino)ethyl 1-phenylcyclopentane-1-carboxylate.
Chemical Property Profile of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester
Property Insights of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester
The XLogP value of 3.2 indicates that Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester 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 Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester?
The CAS number of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester is 4339-96-2.
What is the molecular formula of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester?
The molecular formula of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester is C16H23NO2.
What is the molecular weight of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester?
The molecular weight of Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester is 261.17 g/mol.
Where can I buy Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester?
You can request a quote for Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanecarboxylic acid, 1-phenyl-, 2-(dimethylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.