Isopropyl acrylate
TL;DR: Isopropyl acrylate (CAS 689-12-3) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl prop-2-enoate
Also Known As: Isopropyl acrylate, iso-Propylacrylate, iso-propyl acrylate, Isopropyl 2-propenoate, propan-2-yl prop-2-enoate
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 689-12-3 |
|---|---|
| SMILES | CC(C)OC(=O)C=C |
| InChIKey | LYBIZMNPXTXVMV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isopropyl acrylate (CAS 689-12-3), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: propan-2-yl prop-2-enoate.
Chemical Property Profile of Isopropyl acrylate
Property Insights of Isopropyl acrylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl acrylate. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl 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 Isopropyl acrylate?
The CAS number of Isopropyl acrylate is 689-12-3.
What is the molecular formula of Isopropyl acrylate?
The molecular formula of Isopropyl acrylate is C6H10O2.
What is the molecular weight of Isopropyl acrylate?
The molecular weight of Isopropyl acrylate is 114.07 g/mol.
Where can I buy Isopropyl acrylate?
You can request a quote for Isopropyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for Isopropyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.