Ethane-1,2-diyl bis(4-oxopentanoate)
TL;DR: Ethane-1,2-diyl bis(4-oxopentanoate) (CAS 55486-09-4) is a chemical compound with molecular formula C12H18O6 and molecular weight 258.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-oxopentanoyloxy)ethyl 4-oxopentanoate
Also Known As: ethane-1,2-diyl bis(4-oxopentanoate), Ethanesulfonyl isothiocyanate, 2-(4-oxopentanoyloxy)ethyl 4-oxopentanoate
| Molecular Formula | C12H18O6 |
|---|---|
| Molecular Weight | 258.11 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 258.11035 |
| Heavy Atoms | 18 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 55486-09-4 |
|---|---|
| SMILES | CC(=O)CCC(=O)OCCOC(=O)CCC(=O)C |
| InChIKey | LIQBLYKFSGXMNN-UHFFFAOYSA-N |
Product Overview
Ethane-1,2-diyl bis(4-oxopentanoate) (CAS 55486-09-4), with molecular formula C12H18O6 and molecular weight 258.11 g/mol. IUPAC: 2-(4-oxopentanoyloxy)ethyl 4-oxopentanoate.
Chemical Property Profile of Ethane-1,2-diyl bis(4-oxopentanoate)
Property Insights of Ethane-1,2-diyl bis(4-oxopentanoate)
The XLogP value of -0.8 indicates that Ethane-1,2-diyl bis(4-oxopentanoate) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethane-1,2-diyl bis(4-oxopentanoate). Following Lipinski's Rule of Five, Ethane-1,2-diyl bis(4-oxopentanoate) has 0 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 Ethane-1,2-diyl bis(4-oxopentanoate)?
The CAS number of Ethane-1,2-diyl bis(4-oxopentanoate) is 55486-09-4.
What is the molecular formula of Ethane-1,2-diyl bis(4-oxopentanoate)?
The molecular formula of Ethane-1,2-diyl bis(4-oxopentanoate) is C12H18O6.
What is the molecular weight of Ethane-1,2-diyl bis(4-oxopentanoate)?
The molecular weight of Ethane-1,2-diyl bis(4-oxopentanoate) is 258.11 g/mol.
Where can I buy Ethane-1,2-diyl bis(4-oxopentanoate)?
You can request a quote for Ethane-1,2-diyl bis(4-oxopentanoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethane-1,2-diyl bis(4-oxopentanoate)?
Yes, KEHONG BIO provides custom synthesis services for Ethane-1,2-diyl bis(4-oxopentanoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.