2-Ethylbutyl acrylate
TL;DR: 2-Ethylbutyl acrylate (CAS 3953-10-4) 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.
2-ethylbutyl prop-2-enoate
Also Known As: 2-ETHYLBUTYL ACRYLATE, 2-Ethylbutylacrylate, 2-ethylbutyl prop-2-enoate, 2-Athylbutylacrylat, 2-Ethylbutyl 2-propenoate
| Molecular Formula | C9H16O2 |
|---|---|
| Molecular Weight | 156.12 g/mol |
| LogP | 2.9 |
| 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 | 126.0 |
| Melting Point | -70 °C |
| Boiling Point | 10 °C |
| Density | 0.8964 |
| Solubility | INSOL IN WATER |
| Flash Point | 52 °C |
| Vapor Pressure | 1.7 [mmHg] |
Chemical Identifiers
| CAS Number | 3953-10-4 |
|---|---|
| SMILES | CCC(CC)COC(=O)C=C |
| InChIKey | JGRXEBOFWPLEAV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethylbutyl acrylate (CAS 3953-10-4), with molecular formula C9H16O2 and molecular weight 156.12 g/mol. IUPAC: 2-ethylbutyl prop-2-enoate.
Chemical Property Profile of 2-Ethylbutyl acrylate
Property Insights of 2-Ethylbutyl acrylate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethylbutyl acrylate. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Ethylbutyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylbutyl 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 2-Ethylbutyl acrylate?
The CAS number of 2-Ethylbutyl acrylate is 3953-10-4.
What is the molecular formula of 2-Ethylbutyl acrylate?
The molecular formula of 2-Ethylbutyl acrylate is C9H16O2.
What is the molecular weight of 2-Ethylbutyl acrylate?
The molecular weight of 2-Ethylbutyl acrylate is 156.12 g/mol.
Where can I buy 2-Ethylbutyl acrylate?
You can request a quote for 2-Ethylbutyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylbutyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylbutyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.