Cyclopentanecarboxylic acid, allyl ester
TL;DR: Cyclopentanecarboxylic acid, allyl ester (CAS 178905-33-4) is a chemical compound with molecular formula C9H14O2 and molecular weight 154.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl cyclopentanecarboxylate
Also Known As: Allyl cyclopentanecarboxylate, Allyl cyclopentanecarboxylate #, Prop-2-enyl Cyclopentanecarboxylate, prop-1-en-2-yl cyclopentanecarboxylate, Cyclopentanecarboxylic acid allyl ester
| Molecular Formula | C9H14O2 |
|---|---|
| Molecular Weight | 154.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.09938 |
| Heavy Atoms | 11 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 178905-33-4 |
|---|---|
| SMILES | C=CCOC(=O)C1CCCC1 |
| InChIKey | IFTMCYXLVAINAZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopentanecarboxylic acid, allyl ester (CAS 178905-33-4), with molecular formula C9H14O2 and molecular weight 154.10 g/mol. IUPAC: prop-2-enyl cyclopentanecarboxylate.
Chemical Property Profile of Cyclopentanecarboxylic acid, allyl ester
Property Insights of Cyclopentanecarboxylic acid, allyl ester
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentanecarboxylic acid, allyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclopentanecarboxylic acid, allyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanecarboxylic acid, allyl ester 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
Frequently Asked Questions
What is the CAS number of Cyclopentanecarboxylic acid, allyl ester?
The CAS number of Cyclopentanecarboxylic acid, allyl ester is 178905-33-4.
What is the molecular formula of Cyclopentanecarboxylic acid, allyl ester?
The molecular formula of Cyclopentanecarboxylic acid, allyl ester is C9H14O2.
What is the molecular weight of Cyclopentanecarboxylic acid, allyl ester?
The molecular weight of Cyclopentanecarboxylic acid, allyl ester is 154.10 g/mol.
Where can I buy Cyclopentanecarboxylic acid, allyl ester?
You can request a quote for Cyclopentanecarboxylic acid, allyl 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, allyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentanecarboxylic acid, allyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.