6-Ethoxycarbonyloxyhexyl ethyl carbonate
TL;DR: 6-Ethoxycarbonyloxyhexyl ethyl carbonate (CAS 96536-92-4) is a chemical compound with molecular formula C12H22O6 and molecular weight 262.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethoxycarbonyloxyhexyl ethyl carbonate
Also Known As: 1,6-bis-ethoxycarbonyloxy-hexane, diethyl hexane-1,6-diyl biscarbonate, 6-ethoxycarbonyloxyhexyl ethyl carbonate, Bis(carbonic acid ethyl)1,6-hexanediyl ester, J1.653.772A
| Molecular Formula | C12H22O6 |
|---|---|
| Molecular Weight | 262.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 262.14163 |
| Heavy Atoms | 18 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 96536-92-4 |
|---|---|
| SMILES | CCOC(=O)OCCCCCCOC(=O)OCC |
| InChIKey | WHCKOASRCBRMQF-UHFFFAOYSA-N |
Product Overview
6-Ethoxycarbonyloxyhexyl ethyl carbonate (CAS 96536-92-4), with molecular formula C12H22O6 and molecular weight 262.14 g/mol. IUPAC: 6-ethoxycarbonyloxyhexyl ethyl carbonate.
Chemical Property Profile of 6-Ethoxycarbonyloxyhexyl ethyl carbonate
Property Insights of 6-Ethoxycarbonyloxyhexyl ethyl carbonate
The XLogP value of 3.0 indicates that 6-Ethoxycarbonyloxyhexyl ethyl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Ethoxycarbonyloxyhexyl ethyl carbonate. Following Lipinski's Rule of Five, 6-Ethoxycarbonyloxyhexyl ethyl carbonate 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 6-Ethoxycarbonyloxyhexyl ethyl carbonate?
The CAS number of 6-Ethoxycarbonyloxyhexyl ethyl carbonate is 96536-92-4.
What is the molecular formula of 6-Ethoxycarbonyloxyhexyl ethyl carbonate?
The molecular formula of 6-Ethoxycarbonyloxyhexyl ethyl carbonate is C12H22O6.
What is the molecular weight of 6-Ethoxycarbonyloxyhexyl ethyl carbonate?
The molecular weight of 6-Ethoxycarbonyloxyhexyl ethyl carbonate is 262.14 g/mol.
Where can I buy 6-Ethoxycarbonyloxyhexyl ethyl carbonate?
You can request a quote for 6-Ethoxycarbonyloxyhexyl ethyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethoxycarbonyloxyhexyl ethyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethoxycarbonyloxyhexyl ethyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.