2-Hydroxyethyl 2,3-dibromopropionate
TL;DR: 2-Hydroxyethyl 2,3-dibromopropionate (CAS 68479-77-6) is a chemical compound with molecular formula C5H8Br2O3 and molecular weight 273.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl 2,3-dibromopropanoate
Also Known As: Halt, Caswell No. 487AB, 2-Hydroxyethyl 2,3-dibromopropanoate, 2-Hydroxyethyl 2,3-dibromopropionate, 2-Hydroxyethyl-2,3-dibromopropionate
| Molecular Formula | C5H8Br2O3 |
|---|---|
| Molecular Weight | 273.88 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.88196 |
| Heavy Atoms | 10 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 68479-77-6 |
|---|---|
| SMILES | C(COC(=O)C(CBr)Br)O |
| InChIKey | FODLZNVVRJLINF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxyethyl 2,3-dibromopropionate (CAS 68479-77-6), with molecular formula C5H8Br2O3 and molecular weight 273.88 g/mol. IUPAC: 2-hydroxyethyl 2,3-dibromopropanoate.
Chemical Property Profile of 2-Hydroxyethyl 2,3-dibromopropionate
Property Insights of 2-Hydroxyethyl 2,3-dibromopropionate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl 2,3-dibromopropionate. With a topological polar surface area (TPSA) of 46.5 Ų, 2-Hydroxyethyl 2,3-dibromopropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyethyl 2,3-dibromopropionate 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-Hydroxyethyl 2,3-dibromopropionate?
The CAS number of 2-Hydroxyethyl 2,3-dibromopropionate is 68479-77-6.
What is the molecular formula of 2-Hydroxyethyl 2,3-dibromopropionate?
The molecular formula of 2-Hydroxyethyl 2,3-dibromopropionate is C5H8Br2O3.
What is the molecular weight of 2-Hydroxyethyl 2,3-dibromopropionate?
The molecular weight of 2-Hydroxyethyl 2,3-dibromopropionate is 273.88 g/mol.
Where can I buy 2-Hydroxyethyl 2,3-dibromopropionate?
You can request a quote for 2-Hydroxyethyl 2,3-dibromopropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl 2,3-dibromopropionate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl 2,3-dibromopropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.