Methyl 2-bromodecanoate
TL;DR: Methyl 2-bromodecanoate (CAS 617-60-7) is a chemical compound with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-bromodecanoate
Also Known As: Methyl 2-bromodecanoate, methyl 2-bromododecanoate, METHYL2-BROMODECANOATE, Decanoic acid,2-bromo-, methyl ester, methyl ester of alpha-bromodecanoic acid
| Molecular Formula | C11H21BrO2 |
|---|---|
| Molecular Weight | 264.07 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 264.07248 |
| Heavy Atoms | 14 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 617-60-7 |
|---|---|
| SMILES | CCCCCCCCC(C(=O)OC)Br |
| InChIKey | BTVBXISZWGMHEN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-bromodecanoate (CAS 617-60-7), with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol. IUPAC: methyl 2-bromodecanoate.
Chemical Property Profile of Methyl 2-bromodecanoate
Property Insights of Methyl 2-bromodecanoate
The XLogP value of 4.9 indicates that Methyl 2-bromodecanoate 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 2-bromodecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-bromodecanoate 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 2-bromodecanoate?
The CAS number of Methyl 2-bromodecanoate is 617-60-7.
What is the molecular formula of Methyl 2-bromodecanoate?
The molecular formula of Methyl 2-bromodecanoate is C11H21BrO2.
What is the molecular weight of Methyl 2-bromodecanoate?
The molecular weight of Methyl 2-bromodecanoate is 264.07 g/mol.
Where can I buy Methyl 2-bromodecanoate?
You can request a quote for Methyl 2-bromodecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-bromodecanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-bromodecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.