2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester
TL;DR: 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester (CAS 68141-12-8) is a chemical compound with molecular formula C13H16O3 and molecular weight 220.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 3-(4-methoxyphenyl)prop-2-enoate
Also Known As: Propyl 3-(4-methoxyphenyl)acrylate, propyl-p-methoxycinnamate, Propyl p-methoxycinnamate, Propyl3-(4-methoxyphenyl)acrylate, propyl 3-(4-methoxyphenyl)prop-2-enoate
| Molecular Formula | C13H16O3 |
|---|---|
| Molecular Weight | 220.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 220.10994 |
| Heavy Atoms | 16 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 68141-12-8 |
|---|---|
| SMILES | CCCOC(=O)C=CC1=CC=C(C=C1)OC |
| InChIKey | WZXKPNYMUZGZIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester (CAS 68141-12-8), with molecular formula C13H16O3 and molecular weight 220.11 g/mol. IUPAC: propyl 3-(4-methoxyphenyl)prop-2-enoate.
Chemical Property Profile of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester
Property Insights of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester
The XLogP value of 3.1 indicates that 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester 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 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester?
The CAS number of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester is 68141-12-8.
What is the molecular formula of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester?
The molecular formula of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester is C13H16O3.
What is the molecular weight of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester?
The molecular weight of 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester is 220.11 g/mol.
Where can I buy 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester?
You can request a quote for 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenoic acid, 3-(4-methoxyphenyl)-, propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.