![Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate structure](/static/products/899/89913-72-4.png)
Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate
TL;DR: Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate (CAS 89913-72-4) is a chemical compound with molecular formula C16H23ClO3S and molecular weight 330.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[5-(9-chlorononanoyl)thiophen-2-yl]acetate
Also Known As: 1,8-Heptadecadiene-11,13,15-triyne, methyl 2-[5-(9-chlorononanoyl)thiophen-2-yl]acetate, Methyl [5-(9-chlorononanoyl)thiophen-2-yl]acetate, methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate, 2-Thiopheneacetic acid, 5-(9-chloro-1-oxononyl)-, methyl ester
| Molecular Formula | C16H23ClO3S |
|---|---|
| Molecular Weight | 330.11 g/mol |
| LogP | 4.6158 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 330.10565 |
| Heavy Atoms | 21 |
| Complexity | 442.4854 |
Chemical Identifiers
| CAS Number | 89913-72-4 |
|---|---|
| SMILES | COC(=O)CC1=CC=C(S1)C(=O)CCCCCCCCCl |
Product Overview
Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate (CAS 89913-72-4), with molecular formula C16H23ClO3S and molecular weight 330.11 g/mol. IUPAC: methyl 2-[5-(9-chlorononanoyl)thiophen-2-yl]acetate.
Chemical Property Profile of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate
Property Insights of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate
The XLogP value of 4.6158 indicates that Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate has 0 hydrogen bond donor(s) and 4 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 2-[5-(9-chlorononanoyl)-2-thienyl]acetate?
The CAS number of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate is 89913-72-4.
What is the molecular formula of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate?
The molecular formula of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate is C16H23ClO3S.
What is the molecular weight of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate?
The molecular weight of Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate is 330.11 g/mol.
Where can I buy Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate?
You can request a quote for Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[5-(9-chlorononanoyl)-2-thienyl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.