2-Hydroxybutyl bromoacetate
TL;DR: 2-Hydroxybutyl bromoacetate (CAS 93858-59-4) is a chemical compound with molecular formula C6H11BrO3 and molecular weight 209.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxybutyl 2-bromoacetate
Also Known As: 2-Hydroxybutyl bromoacetate, 2-hydroxybutylbromoacetate, 2-hydroxybutyl 2-bromoacetate, EINECS 299-291-7, Bromoacetic acid 2-hydroxybutyl ester
| Molecular Formula | C6H11BrO3 |
|---|---|
| Molecular Weight | 209.99 g/mol |
| LogP | 0.6954 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.98917 |
| Heavy Atoms | 10 |
| Complexity | 105.16605 |
Chemical Identifiers
| CAS Number | 93858-59-4 |
|---|---|
| SMILES | CCC(COC(=O)CBr)O |
Product Overview
2-Hydroxybutyl bromoacetate (CAS 93858-59-4), with molecular formula C6H11BrO3 and molecular weight 209.99 g/mol. IUPAC: 2-hydroxybutyl 2-bromoacetate.
Chemical Property Profile of 2-Hydroxybutyl bromoacetate
Property Insights of 2-Hydroxybutyl bromoacetate
The XLogP value of 0.6954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxybutyl bromoacetate. With a topological polar surface area (TPSA) of 46.53 Ų, 2-Hydroxybutyl bromoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxybutyl bromoacetate has 1 hydrogen bond donor(s) and 3 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-Hydroxybutyl bromoacetate?
The CAS number of 2-Hydroxybutyl bromoacetate is 93858-59-4.
What is the molecular formula of 2-Hydroxybutyl bromoacetate?
The molecular formula of 2-Hydroxybutyl bromoacetate is C6H11BrO3.
What is the molecular weight of 2-Hydroxybutyl bromoacetate?
The molecular weight of 2-Hydroxybutyl bromoacetate is 209.99 g/mol.
Where can I buy 2-Hydroxybutyl bromoacetate?
You can request a quote for 2-Hydroxybutyl bromoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxybutyl bromoacetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxybutyl bromoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.