2-Propyl-2-pentenoic acid
TL;DR: 2-Propyl-2-pentenoic acid (CAS 60218-41-9) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propylpent-2-enoic acid
Also Known As: 2-propylpent-2-enoic acid, 2-Propyl-2-pentenoic acid, 2-Pentenoic acid, 2-propyl-, 2-envalproic acid, delta2-Valproic acid
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 60218-41-9 |
|---|---|
| SMILES | CCCC(=CCC)C(=O)O |
| InChIKey | ZKNJEOBYOLUGKJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propyl-2-pentenoic acid (CAS 60218-41-9), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: 2-propylpent-2-enoic acid.
Chemical Property Profile of 2-Propyl-2-pentenoic acid
Property Insights of 2-Propyl-2-pentenoic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propyl-2-pentenoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Propyl-2-pentenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propyl-2-pentenoic acid has 1 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 2-Propyl-2-pentenoic acid?
The CAS number of 2-Propyl-2-pentenoic acid is 60218-41-9.
What is the molecular formula of 2-Propyl-2-pentenoic acid?
The molecular formula of 2-Propyl-2-pentenoic acid is C8H14O2.
What is the molecular weight of 2-Propyl-2-pentenoic acid?
The molecular weight of 2-Propyl-2-pentenoic acid is 142.10 g/mol.
Where can I buy 2-Propyl-2-pentenoic acid?
You can request a quote for 2-Propyl-2-pentenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propyl-2-pentenoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Propyl-2-pentenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.