Ethyl octyl carbonate
TL;DR: Ethyl octyl carbonate (CAS 45130-04-9) is a chemical compound with molecular formula C11H22O3 and molecular weight 202.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl octyl carbonate
Also Known As: ethyl octyl carbonate, Carbonic acid, ethyl octyl ester, Carbonic acid ethyloctyl ester, J1.653.774H
| Molecular Formula | C11H22O3 |
|---|---|
| Molecular Weight | 202.16 g/mol |
| LogP | 3.52 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 202.15689 |
| Heavy Atoms | 14 |
| Complexity | 134.49434 |
Chemical Identifiers
| CAS Number | 45130-04-9 |
|---|---|
| SMILES | CCCCCCCCOC(=O)OCC |
Product Overview
Ethyl octyl carbonate (CAS 45130-04-9), with molecular formula C11H22O3 and molecular weight 202.16 g/mol. IUPAC: ethyl octyl carbonate.
Chemical Property Profile of Ethyl octyl carbonate
Property Insights of Ethyl octyl carbonate
The XLogP value of 3.52 indicates that Ethyl octyl carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Ethyl octyl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl octyl carbonate has 0 hydrogen bond donor(s) and 3 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 Ethyl octyl carbonate?
The CAS number of Ethyl octyl carbonate is 45130-04-9.
What is the molecular formula of Ethyl octyl carbonate?
The molecular formula of Ethyl octyl carbonate is C11H22O3.
What is the molecular weight of Ethyl octyl carbonate?
The molecular weight of Ethyl octyl carbonate is 202.16 g/mol.
Where can I buy Ethyl octyl carbonate?
You can request a quote for Ethyl octyl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl octyl carbonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl octyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.