2-Pentenoic acid
TL;DR: 2-Pentenoic acid (CAS 626-98-2) is a chemical compound with molecular formula C5H8O2 and molecular weight 100.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pent-2-enoic acid
Also Known As: Pent-2-enoic acid, Pentenoic acid, 2-PENTENOIC ACID, n-pentenoic acid, Amicetose
| Molecular Formula | C5H8O2 |
|---|---|
| Molecular Weight | 100.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 100.05243 |
| Heavy Atoms | 7 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 626-98-2 |
|---|---|
| SMILES | CCC=CC(=O)O |
| InChIKey | YIYBQIKDCADOSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Pentenoic acid (CAS 626-98-2), with molecular formula C5H8O2 and molecular weight 100.05 g/mol. IUPAC: pent-2-enoic acid.
Chemical Property Profile of 2-Pentenoic acid
Property Insights of 2-Pentenoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pentenoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Pentenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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-Pentenoic acid?
The CAS number of 2-Pentenoic acid is 626-98-2.
What is the molecular formula of 2-Pentenoic acid?
The molecular formula of 2-Pentenoic acid is C5H8O2.
What is the molecular weight of 2-Pentenoic acid?
The molecular weight of 2-Pentenoic acid is 100.05 g/mol.
Where can I buy 2-Pentenoic acid?
You can request a quote for 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-Pentenoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.