2-Methoxyphenyl 3-phenylprop-2-enoate
TL;DR: 2-Methoxyphenyl 3-phenylprop-2-enoate (CAS 531-40-8) is a chemical compound with molecular formula C16H14O3 and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxyphenyl) 3-phenylprop-2-enoate
Also Known As: Guaiacol cinnamate, 2-Methoxyphenyl cinnamate, Cinnamic acid, o-methoxyphenyl ester, 2-methoxyphenyl 3-phenylprop-2-enoate, (2-methoxyphenyl) 3-phenylprop-2-enoate
| Molecular Formula | C16H14O3 |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 254.0943 |
| Heavy Atoms | 19 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 531-40-8 |
|---|---|
| SMILES | COC1=CC=CC=C1OC(=O)C=CC2=CC=CC=C2 |
| InChIKey | SYKAZDSPTNFPJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxyphenyl 3-phenylprop-2-enoate (CAS 531-40-8), with molecular formula C16H14O3 and molecular weight 254.09 g/mol. IUPAC: (2-methoxyphenyl) 3-phenylprop-2-enoate.
Chemical Property Profile of 2-Methoxyphenyl 3-phenylprop-2-enoate
Property Insights of 2-Methoxyphenyl 3-phenylprop-2-enoate
The XLogP value of 3.5 indicates that 2-Methoxyphenyl 3-phenylprop-2-enoate 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-Methoxyphenyl 3-phenylprop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxyphenyl 3-phenylprop-2-enoate 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-Methoxyphenyl 3-phenylprop-2-enoate?
The CAS number of 2-Methoxyphenyl 3-phenylprop-2-enoate is 531-40-8.
What is the molecular formula of 2-Methoxyphenyl 3-phenylprop-2-enoate?
The molecular formula of 2-Methoxyphenyl 3-phenylprop-2-enoate is C16H14O3.
What is the molecular weight of 2-Methoxyphenyl 3-phenylprop-2-enoate?
The molecular weight of 2-Methoxyphenyl 3-phenylprop-2-enoate is 254.09 g/mol.
Where can I buy 2-Methoxyphenyl 3-phenylprop-2-enoate?
You can request a quote for 2-Methoxyphenyl 3-phenylprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxyphenyl 3-phenylprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxyphenyl 3-phenylprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.