Methyl 4-chlorodecanoate
TL;DR: Methyl 4-chlorodecanoate (CAS 91375-75-6) 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.
methyl 4-chlorodecanoate
Also Known As: Methyl 4-chlorodecanoate, 4-Chlorodecanoic acid, methyl ester, Decanoic acid, 4-chloro-, methyl ester
| Molecular Formula | C11H21ClO2 |
|---|---|
| Molecular Weight | 220.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 220.123 |
| Heavy Atoms | 14 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 91375-75-6 |
|---|---|
| SMILES | CCCCCCC(CCC(=O)OC)Cl |
| InChIKey | QTFAZTCKINPKQC-UHFFFAOYSA-N |
Product Overview
Methyl 4-chlorodecanoate (CAS 91375-75-6), with molecular formula C11H21ClO2 and molecular weight 220.12 g/mol. IUPAC: methyl 4-chlorodecanoate.
Chemical Property Profile of Methyl 4-chlorodecanoate
Property Insights of Methyl 4-chlorodecanoate
The XLogP value of 3.9 indicates that Methyl 4-chlorodecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 4-chlorodecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-chlorodecanoate 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 Methyl 4-chlorodecanoate?
The CAS number of Methyl 4-chlorodecanoate is 91375-75-6.
What is the molecular formula of Methyl 4-chlorodecanoate?
The molecular formula of Methyl 4-chlorodecanoate is C11H21ClO2.
What is the molecular weight of Methyl 4-chlorodecanoate?
The molecular weight of Methyl 4-chlorodecanoate is 220.12 g/mol.
Where can I buy Methyl 4-chlorodecanoate?
You can request a quote for Methyl 4-chlorodecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-chlorodecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-chlorodecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.