alpha-Pentylacrylic Acid
TL;DR: alpha-Pentylacrylic Acid (CAS 4436-84-4) 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-methylideneheptanoic acid
Also Known As: 2-methyleneheptanoic acid, heptene-2-carboxylic, alpha-Pentylacrylic Acid, 2-methylideneheptanoic Acid
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 2.2075 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 127.219284 |
Chemical Identifiers
| CAS Number | 4436-84-4 |
|---|---|
| SMILES | CCCCCC(=C)C(=O)O |
Product Overview
alpha-Pentylacrylic Acid (CAS 4436-84-4), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: 2-methylideneheptanoic acid.
Chemical Property Profile of alpha-Pentylacrylic Acid
Property Insights of alpha-Pentylacrylic Acid
The XLogP value of 2.2075 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Pentylacrylic Acid. With a topological polar surface area (TPSA) of 37.3 Ų, alpha-Pentylacrylic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Pentylacrylic Acid has 1 hydrogen bond donor(s) and 1 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 alpha-Pentylacrylic Acid?
The CAS number of alpha-Pentylacrylic Acid is 4436-84-4.
What is the molecular formula of alpha-Pentylacrylic Acid?
The molecular formula of alpha-Pentylacrylic Acid is C8H14O2.
What is the molecular weight of alpha-Pentylacrylic Acid?
The molecular weight of alpha-Pentylacrylic Acid is 142.10 g/mol.
Where can I buy alpha-Pentylacrylic Acid?
You can request a quote for alpha-Pentylacrylic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Pentylacrylic Acid?
Yes, KEHONG BIO provides custom synthesis services for alpha-Pentylacrylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.