3-Phenylprop-2-enoic anhydride
TL;DR: 3-Phenylprop-2-enoic anhydride (CAS 538-56-7) is a chemical compound with molecular formula C18H14O3 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylprop-2-enoyl 3-phenylprop-2-enoate
Also Known As: Cinnamic anhydride, trans-Cinnamic anhydride, Cinnamic acid anhydride, NCIOpen2_004218, 3-phenylprop-2-enoic anhydride
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 538-56-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC(=O)OC(=O)C=CC2=CC=CC=C2 |
| InChIKey | FXEDRSGUZBCDMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenylprop-2-enoic anhydride (CAS 538-56-7), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: 3-phenylprop-2-enoyl 3-phenylprop-2-enoate.
Chemical Property Profile of 3-Phenylprop-2-enoic anhydride
Property Insights of 3-Phenylprop-2-enoic anhydride
The XLogP value of 4.1 indicates that 3-Phenylprop-2-enoic anhydride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Phenylprop-2-enoic anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylprop-2-enoic anhydride 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-Phenylprop-2-enoic anhydride?
The CAS number of 3-Phenylprop-2-enoic anhydride is 538-56-7.
What is the molecular formula of 3-Phenylprop-2-enoic anhydride?
The molecular formula of 3-Phenylprop-2-enoic anhydride is C18H14O3.
What is the molecular weight of 3-Phenylprop-2-enoic anhydride?
The molecular weight of 3-Phenylprop-2-enoic anhydride is 278.09 g/mol.
Where can I buy 3-Phenylprop-2-enoic anhydride?
You can request a quote for 3-Phenylprop-2-enoic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenylprop-2-enoic anhydride?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylprop-2-enoic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.