2,6-Dimethylheptan-4-yl bromoacetate
TL;DR: 2,6-Dimethylheptan-4-yl bromoacetate (CAS 69095-82-5) 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.
2,6-dimethylheptan-4-yl 2-bromoacetate
Also Known As: 2,6-dimethylheptan-4-yl bromoacetate, 2,6-dimethylheptan-4-yl 2-bromoacetate
| Molecular Formula | C11H21BrO2 |
|---|---|
| Molecular Weight | 264.07 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.07248 |
| Heavy Atoms | 14 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 69095-82-5 |
|---|---|
| SMILES | CC(C)CC(CC(C)C)OC(=O)CBr |
| InChIKey | ZGTHVYKDMSKODS-UHFFFAOYSA-N |
Product Overview
2,6-Dimethylheptan-4-yl bromoacetate (CAS 69095-82-5), with molecular formula C11H21BrO2 and molecular weight 264.07 g/mol. IUPAC: 2,6-dimethylheptan-4-yl 2-bromoacetate.
Chemical Property Profile of 2,6-Dimethylheptan-4-yl bromoacetate
Property Insights of 2,6-Dimethylheptan-4-yl bromoacetate
The XLogP value of 4.3 indicates that 2,6-Dimethylheptan-4-yl bromoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,6-Dimethylheptan-4-yl bromoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethylheptan-4-yl bromoacetate 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 2,6-Dimethylheptan-4-yl bromoacetate?
The CAS number of 2,6-Dimethylheptan-4-yl bromoacetate is 69095-82-5.
What is the molecular formula of 2,6-Dimethylheptan-4-yl bromoacetate?
The molecular formula of 2,6-Dimethylheptan-4-yl bromoacetate is C11H21BrO2.
What is the molecular weight of 2,6-Dimethylheptan-4-yl bromoacetate?
The molecular weight of 2,6-Dimethylheptan-4-yl bromoacetate is 264.07 g/mol.
Where can I buy 2,6-Dimethylheptan-4-yl bromoacetate?
You can request a quote for 2,6-Dimethylheptan-4-yl bromoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethylheptan-4-yl bromoacetate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethylheptan-4-yl bromoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.