3-Phenylprop-2-ynyl 3-phenylprop-2-enoate
TL;DR: 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate (CAS 61019-08-7) is a chemical compound with molecular formula C18H14O2 and molecular weight 262.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylprop-2-ynyl 3-phenylprop-2-enoate
Also Known As: NCIOpen2_004505, 3-phenylprop-2-ynyl 3-phenylprop-2-enoate, 3-phenylprop-2-yn-1-yl 3-phenylprop-2-enoate, 2-Propenoic acid, 3-phenyl-, 3-phenyl-2-propynyl ester, (Z)-
| Molecular Formula | C18H14O2 |
|---|---|
| Molecular Weight | 262.10 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 262.09937 |
| Heavy Atoms | 20 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 61019-08-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC(=O)OCC#CC2=CC=CC=C2 |
| InChIKey | CTFXGKKESWKQJA-UHFFFAOYSA-N |
Product Overview
3-Phenylprop-2-ynyl 3-phenylprop-2-enoate (CAS 61019-08-7), with molecular formula C18H14O2 and molecular weight 262.10 g/mol. IUPAC: 3-phenylprop-2-ynyl 3-phenylprop-2-enoate.
Chemical Property Profile of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate
Property Insights of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate
The XLogP value of 4.2 indicates that 3-Phenylprop-2-ynyl 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 26.3 Ų, 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate 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 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate?
The CAS number of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate is 61019-08-7.
What is the molecular formula of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate?
The molecular formula of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate is C18H14O2.
What is the molecular weight of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate?
The molecular weight of 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate is 262.10 g/mol.
Where can I buy 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate?
You can request a quote for 3-Phenylprop-2-ynyl 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 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenylprop-2-ynyl 3-phenylprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.