2-Butyloctyl bromoacetate
TL;DR: 2-Butyloctyl bromoacetate (CAS 10161-88-3) is a chemical compound with molecular formula C14H27BrO2 and molecular weight 306.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyloctyl 2-bromoacetate
Also Known As: 2-butyloctyl bromoacetate, 2-butyloctyl 2-bromoacetate
| Molecular Formula | C14H27BrO2 |
|---|---|
| Molecular Weight | 306.12 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 306.11945 |
| Heavy Atoms | 17 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 10161-88-3 |
|---|---|
| SMILES | CCCCCCC(CCCC)COC(=O)CBr |
| InChIKey | PIBYANMZXWTHQM-UHFFFAOYSA-N |
Product Overview
2-Butyloctyl bromoacetate (CAS 10161-88-3), with molecular formula C14H27BrO2 and molecular weight 306.12 g/mol. IUPAC: 2-butyloctyl 2-bromoacetate.
Chemical Property Profile of 2-Butyloctyl bromoacetate
Property Insights of 2-Butyloctyl bromoacetate
The XLogP value of 6.2 indicates that 2-Butyloctyl 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-Butyloctyl bromoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyloctyl bromoacetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Butyloctyl bromoacetate?
The CAS number of 2-Butyloctyl bromoacetate is 10161-88-3.
What is the molecular formula of 2-Butyloctyl bromoacetate?
The molecular formula of 2-Butyloctyl bromoacetate is C14H27BrO2.
What is the molecular weight of 2-Butyloctyl bromoacetate?
The molecular weight of 2-Butyloctyl bromoacetate is 306.12 g/mol.
Where can I buy 2-Butyloctyl bromoacetate?
You can request a quote for 2-Butyloctyl bromoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butyloctyl bromoacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Butyloctyl bromoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.