EINECS 262-874-1
TL;DR: EINECS 262-874-1 (CAS 61618-92-6) is a chemical compound with molecular formula C28H38F2O5 and molecular weight 492.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6S,8S,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hexanoate
Also Known As: EINECS 262-874-1, 6alpha,9-Difluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-hexanoate, 6,9-Difluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl hexanoate, 6I<<,9-difluoro-11EC,21-dihydroxy-16I<<-methylpregna-1,4-diene-3,20-dione 21-hexanoate, (9xi)-6alpha,9-Difluoro-11beta-hydroxy-16alpha-methyl-3,20-dioxopregna-1,4-dien-21-yl hexanoate
| Molecular Formula | C28H38F2O5 |
|---|---|
| Molecular Weight | 492.27 g/mol |
| LogP | 4.86 |
| Topological Polar Surface Area | 80.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.26874 |
| Heavy Atoms | 35 |
| Complexity | 958.9943 |
Chemical Identifiers
| CAS Number | 61618-92-6 |
|---|---|
| SMILES | CCCCCC(=O)OCC(=O)[C@H]1[C@@H](C[C@@H]2[C@@]1(C[C@@H](C3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)C |
Product Overview
EINECS 262-874-1 (CAS 61618-92-6), with molecular formula C28H38F2O5 and molecular weight 492.27 g/mol. IUPAC: [2-[(6S,8S,10S,11S,13S,14S,16R,17S)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-7,8,11,12,14,15,16,17-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hexanoate.
Chemical Property Profile of EINECS 262-874-1
Property Insights of EINECS 262-874-1
The XLogP value of 4.86 indicates that EINECS 262-874-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.67 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 262-874-1. Following Lipinski's Rule of Five, EINECS 262-874-1 has 1 hydrogen bond donor(s) and 5 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 262-874-1?
The CAS number of EINECS 262-874-1 is 61618-92-6.
What is the molecular formula of EINECS 262-874-1?
The molecular formula of EINECS 262-874-1 is C28H38F2O5.
What is the molecular weight of EINECS 262-874-1?
The molecular weight of EINECS 262-874-1 is 492.27 g/mol.
Where can I buy EINECS 262-874-1?
You can request a quote for EINECS 262-874-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 262-874-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 262-874-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.