EINECS 262-502-8
TL;DR: EINECS 262-502-8 (CAS 60864-74-6) is a chemical compound with molecular formula C24H30BrFO6 and molecular weight 512.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6R,8S,9S,10S,11R,13S,14S,16S,17R)-2-bromo-6-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: EINECS 262-502-8, 2-Bromo-6beta-fluoro-11alpha,17,21-trihydroxy-16beta-methylpregna-1,4-diene-3,20-dione 21-acetate, [2-[(6R,8S,9S,10S,11R,13S,14S,16S,17R)-2-bromo-6-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate, 2-[(1R,2S,3aS,3bS,5R,9aS,9bS,10R,11aS)-8-bromo-5-fluoro-1,10-dihydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-oxoethyl acetate, 2-Bromo-6beta-fluoro-11alpha,17-dihydroxy-16beta-methyl-3,20-dioxopregna-1,4-dien-21-yl acetate
| Molecular Formula | C24H30BrFO6 |
|---|---|
| Molecular Weight | 512.12 g/mol |
| LogP | 3.045 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 512.121 |
| Heavy Atoms | 32 |
| Complexity | 944.7739 |
Chemical Identifiers
| CAS Number | 60864-74-6 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3C[C@H](C4=CC(=O)C(=C[C@@]4([C@H]3[C@@H](C[C@@]2([C@]1(C(=O)COC(=O)C)O)C)O)C)Br)F |
Product Overview
EINECS 262-502-8 (CAS 60864-74-6), with molecular formula C24H30BrFO6 and molecular weight 512.12 g/mol. IUPAC: [2-[(6R,8S,9S,10S,11R,13S,14S,16S,17R)-2-bromo-6-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of EINECS 262-502-8
Property Insights of EINECS 262-502-8
The XLogP value of 3.045 indicates that EINECS 262-502-8 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for EINECS 262-502-8. Following Lipinski's Rule of Five, EINECS 262-502-8 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 262-502-8?
The CAS number of EINECS 262-502-8 is 60864-74-6.
What is the molecular formula of EINECS 262-502-8?
The molecular formula of EINECS 262-502-8 is C24H30BrFO6.
What is the molecular weight of EINECS 262-502-8?
The molecular weight of EINECS 262-502-8 is 512.12 g/mol.
Where can I buy EINECS 262-502-8?
You can request a quote for EINECS 262-502-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 262-502-8?
Yes, KEHONG BIO provides custom synthesis services for EINECS 262-502-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.