EINECS 239-436-3
TL;DR: EINECS 239-436-3 (CAS 1567-56-2) is a chemical compound with molecular formula C27H37FO5 and molecular weight 460.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
EINECS 239-436-3
(17-acetyl-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl) pentanoate
Also Known As: 9-fluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-17-yl pentanoate, (17-acetyl-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl) pentanoate
| Molecular Formula | C27H37FO5 |
|---|---|
| Molecular Weight | 460.26 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 460.2625 |
| Heavy Atoms | 33 |
| Complexity | 939.0 |
Chemical Identifiers
| CAS Number | 1567-56-2 |
|---|---|
| SMILES | CCCCC(=O)OC1(C(CC2C1(CC(C3(C2CCC4=CC(=O)C=CC43C)F)O)C)C)C(=O)C |
| InChIKey | TYNWNTXJZVLQLQ-UHFFFAOYSA-N |
Product Overview
EINECS 239-436-3 (CAS 1567-56-2), with molecular formula C27H37FO5 and molecular weight 460.26 g/mol. IUPAC: (17-acetyl-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl) pentanoate.
Chemical Property Profile of EINECS 239-436-3
Property Insights of EINECS 239-436-3
The XLogP value of 4.0 indicates that EINECS 239-436-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 239-436-3. Following Lipinski's Rule of Five, EINECS 239-436-3 has 1 hydrogen bond donor(s) and 6 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 EINECS 239-436-3?
The CAS number of EINECS 239-436-3 is 1567-56-2.
What is the molecular formula of EINECS 239-436-3?
The molecular formula of EINECS 239-436-3 is C27H37FO5.
What is the molecular weight of EINECS 239-436-3?
The molecular weight of EINECS 239-436-3 is 460.26 g/mol.
Where can I buy EINECS 239-436-3?
You can request a quote for EINECS 239-436-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 239-436-3?
Yes, KEHONG BIO provides custom synthesis services for EINECS 239-436-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.