2-Chloroethyl nonanoate
TL;DR: 2-Chloroethyl nonanoate (CAS 7744-80-1) is a chemical compound with molecular formula C11H21ClO2 and molecular weight 220.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl nonanoate
Also Known As: 2-chloroethyl nonanoate, Nonanoic acid 2-chloroethyl ester, Nonanoic acid, 2-chloroethyl ester, J2.888.089H
| Molecular Formula | C11H21ClO2 |
|---|---|
| Molecular Weight | 220.12 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 220.123 |
| Heavy Atoms | 14 |
| Complexity | 137.0 |
Chemical Identifiers
| CAS Number | 7744-80-1 |
|---|---|
| SMILES | CCCCCCCCC(=O)OCCCl |
| InChIKey | QKSSIMYMJNDYTD-UHFFFAOYSA-N |
Product Overview
2-Chloroethyl nonanoate (CAS 7744-80-1), with molecular formula C11H21ClO2 and molecular weight 220.12 g/mol. IUPAC: 2-chloroethyl nonanoate.
Chemical Property Profile of 2-Chloroethyl nonanoate
Property Insights of 2-Chloroethyl nonanoate
The XLogP value of 4.2 indicates that 2-Chloroethyl nonanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Chloroethyl nonanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl nonanoate has 0 hydrogen bond donor(s) and 2 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 2-Chloroethyl nonanoate?
The CAS number of 2-Chloroethyl nonanoate is 7744-80-1.
What is the molecular formula of 2-Chloroethyl nonanoate?
The molecular formula of 2-Chloroethyl nonanoate is C11H21ClO2.
What is the molecular weight of 2-Chloroethyl nonanoate?
The molecular weight of 2-Chloroethyl nonanoate is 220.12 g/mol.
Where can I buy 2-Chloroethyl nonanoate?
You can request a quote for 2-Chloroethyl nonanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl nonanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl nonanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.