(3,4-Dihydro-2H-pyran-2-yl)methyl acrylate
TL;DR: (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate (CAS 4563-40-0) is a chemical compound with molecular formula C9H12O3 and molecular weight 168.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-2H-pyran-2-ylmethyl prop-2-enoate
Also Known As: Methylacrylate, (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate, 3,4-dihydro-2H-pyran-2-ylmethyl prop-2-enoate, (3,4-Dihydro-2H-pyran-2-yl)methyl prop-2-enoate, Acrylic acid [(3,4-dihydro-2H-pyran)-2-yl]methyl ester
| Molecular Formula | C9H12O3 |
|---|---|
| Molecular Weight | 168.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.07864 |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 4563-40-0 |
|---|---|
| SMILES | C=CC(=O)OCC1CCC=CO1 |
| InChIKey | ZPMJPLRFVUUDDF-UHFFFAOYSA-N |
Product Overview
(3,4-Dihydro-2H-pyran-2-yl)methyl acrylate (CAS 4563-40-0), with molecular formula C9H12O3 and molecular weight 168.08 g/mol. IUPAC: 3,4-dihydro-2H-pyran-2-ylmethyl prop-2-enoate.
Chemical Property Profile of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate
Property Insights of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate. With a topological polar surface area (TPSA) of 35.5 Ų, (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate has 0 hydrogen bond donor(s) and 3 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 (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate?
The CAS number of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate is 4563-40-0.
What is the molecular formula of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate?
The molecular formula of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate is C9H12O3.
What is the molecular weight of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate?
The molecular weight of (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate is 168.08 g/mol.
Where can I buy (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate?
You can request a quote for (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dihydro-2H-pyran-2-yl)methyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.