Methyl 2-bromo-2,3-dichloropropanoate
TL;DR: Methyl 2-bromo-2,3-dichloropropanoate (CAS 6302-47-2) is a chemical compound with molecular formula C4H5BrCl2O2 and molecular weight 233.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-bromo-2,3-dichloropropanoate
Also Known As: methyl 2-bromo-2,3-dichloropropanoate, METHYL 2-BROMO-2,3-DICHLORO-PROPANOATE, RefChem:354108
| Molecular Formula | C4H5BrCl2O2 |
|---|---|
| Molecular Weight | 233.88 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.885 |
| Heavy Atoms | 9 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 6302-47-2 |
|---|---|
| SMILES | COC(=O)C(CCl)(Cl)Br |
| InChIKey | VLOFZLUZKNKBBZ-UHFFFAOYSA-N |
Product Overview
Methyl 2-bromo-2,3-dichloropropanoate (CAS 6302-47-2), with molecular formula C4H5BrCl2O2 and molecular weight 233.88 g/mol. IUPAC: methyl 2-bromo-2,3-dichloropropanoate.
Chemical Property Profile of Methyl 2-bromo-2,3-dichloropropanoate
Property Insights of Methyl 2-bromo-2,3-dichloropropanoate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-bromo-2,3-dichloropropanoate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2-bromo-2,3-dichloropropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-bromo-2,3-dichloropropanoate 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-bromo-2,3-dichloropropanoate?
The CAS number of Methyl 2-bromo-2,3-dichloropropanoate is 6302-47-2.
What is the molecular formula of Methyl 2-bromo-2,3-dichloropropanoate?
The molecular formula of Methyl 2-bromo-2,3-dichloropropanoate is C4H5BrCl2O2.
What is the molecular weight of Methyl 2-bromo-2,3-dichloropropanoate?
The molecular weight of Methyl 2-bromo-2,3-dichloropropanoate is 233.88 g/mol.
Where can I buy Methyl 2-bromo-2,3-dichloropropanoate?
You can request a quote for Methyl 2-bromo-2,3-dichloropropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-bromo-2,3-dichloropropanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-bromo-2,3-dichloropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.