7-phenylhept-2-en-4,6-diynyl Acetate
TL;DR: 7-phenylhept-2-en-4,6-diynyl Acetate (CAS 20252-43-1) is a chemical compound with molecular formula C15H12O2 and molecular weight 224.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-phenylhept-2-en-4,6-diynyl acetate
Also Known As: 7-phenylhept-2-en-4,6-diynyl Acetate, 7-phenylhept-2-ene-4,6-diyn-1-yl acetate, 2-Heptene-4,6-diyn-1-ol, 7-phenyl-, acetate
| Molecular Formula | C15H12O2 |
|---|---|
| Molecular Weight | 224.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.08372 |
| Heavy Atoms | 17 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 20252-43-1 |
|---|---|
| SMILES | CC(=O)OCC=CC#CC#CC1=CC=CC=C1 |
| InChIKey | JEAKICNMCJBNSA-UHFFFAOYSA-N |
Product Overview
7-phenylhept-2-en-4,6-diynyl Acetate (CAS 20252-43-1), with molecular formula C15H12O2 and molecular weight 224.08 g/mol. IUPAC: 7-phenylhept-2-en-4,6-diynyl acetate.
Chemical Property Profile of 7-phenylhept-2-en-4,6-diynyl Acetate
Property Insights of 7-phenylhept-2-en-4,6-diynyl Acetate
The XLogP value of 3.0 indicates that 7-phenylhept-2-en-4,6-diynyl Acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 7-phenylhept-2-en-4,6-diynyl Acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-phenylhept-2-en-4,6-diynyl Acetate 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 7-phenylhept-2-en-4,6-diynyl Acetate?
The CAS number of 7-phenylhept-2-en-4,6-diynyl Acetate is 20252-43-1.
What is the molecular formula of 7-phenylhept-2-en-4,6-diynyl Acetate?
The molecular formula of 7-phenylhept-2-en-4,6-diynyl Acetate is C15H12O2.
What is the molecular weight of 7-phenylhept-2-en-4,6-diynyl Acetate?
The molecular weight of 7-phenylhept-2-en-4,6-diynyl Acetate is 224.08 g/mol.
Where can I buy 7-phenylhept-2-en-4,6-diynyl Acetate?
You can request a quote for 7-phenylhept-2-en-4,6-diynyl Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-phenylhept-2-en-4,6-diynyl Acetate?
Yes, KEHONG BIO provides custom synthesis services for 7-phenylhept-2-en-4,6-diynyl Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.