6-Acetylphenanthren-3-yl acetate
TL;DR: 6-Acetylphenanthren-3-yl acetate (CAS 59504-75-5) 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.
(6-acetylphenanthren-3-yl) acetate
Also Known As: 6-acetylphenanthren-3-yl acetate, (6-acetylphenanthren-3-yl) acetate, 6-acetyl-3-phenanthryl acetate, 6-HYDROXY-3-PHENANTHRYL METHYL KETONE, ACETATE
| Molecular Formula | C18H14O3 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.0943 |
| Heavy Atoms | 21 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 59504-75-5 |
|---|---|
| SMILES | CC(=O)C1=CC2=C(C=CC3=C2C=C(C=C3)OC(=O)C)C=C1 |
| InChIKey | XKSUOAMGEJABCF-UHFFFAOYSA-N |
Product Overview
6-Acetylphenanthren-3-yl acetate (CAS 59504-75-5), with molecular formula C18H14O3 and molecular weight 278.09 g/mol. IUPAC: (6-acetylphenanthren-3-yl) acetate.
Chemical Property Profile of 6-Acetylphenanthren-3-yl acetate
Property Insights of 6-Acetylphenanthren-3-yl acetate
The XLogP value of 3.9 indicates that 6-Acetylphenanthren-3-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 6-Acetylphenanthren-3-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Acetylphenanthren-3-yl acetate 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 6-Acetylphenanthren-3-yl acetate?
The CAS number of 6-Acetylphenanthren-3-yl acetate is 59504-75-5.
What is the molecular formula of 6-Acetylphenanthren-3-yl acetate?
The molecular formula of 6-Acetylphenanthren-3-yl acetate is C18H14O3.
What is the molecular weight of 6-Acetylphenanthren-3-yl acetate?
The molecular weight of 6-Acetylphenanthren-3-yl acetate is 278.09 g/mol.
Where can I buy 6-Acetylphenanthren-3-yl acetate?
You can request a quote for 6-Acetylphenanthren-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Acetylphenanthren-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 6-Acetylphenanthren-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.