4-Methylpentyl acrylate
TL;DR: 4-Methylpentyl acrylate (CAS 5143-30-6) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylpentyl prop-2-enoate
Also Known As: 4-Methylpentyl acrylate, isohexyl acrylate, 4-methylpentyl prop-2-enoate, 4-methylpentylacrylate, 2-Propenoic acid,4-methylpentyl ester
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 156.11504 |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 5143-30-6 |
|---|---|
| SMILES | CC(C)CCCOC(=O)C=C |
| InChIKey | BDMYQVMQTKUZNB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methylpentyl acrylate (CAS 5143-30-6), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: 4-methylpentyl prop-2-enoate.
Chemical Property Profile of 4-Methylpentyl acrylate
Property Insights of 4-Methylpentyl acrylate
The XLogP value of 3.2 indicates that 4-Methylpentyl acrylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Methylpentyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylpentyl acrylate 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 4-Methylpentyl acrylate?
The CAS number of 4-Methylpentyl acrylate is 5143-30-6.
What is the molecular formula of 4-Methylpentyl acrylate?
The molecular formula of 4-Methylpentyl acrylate is C9H16O2.
What is the molecular weight of 4-Methylpentyl acrylate?
The molecular weight of 4-Methylpentyl acrylate is 156.12 g/mol.
Where can I buy 4-Methylpentyl acrylate?
You can request a quote for 4-Methylpentyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylpentyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylpentyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.