Methyl 5-(bromomethyl)furan-2-carboxylate
TL;DR: Methyl 5-(bromomethyl)furan-2-carboxylate (CAS 70117-25-8) is a chemical compound with molecular formula C7H7BrO3 and molecular weight 217.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(bromomethyl)furan-2-carboxylate
Also Known As: methyl 5-(bromomethyl)furan-2-carboxylate, Methyl 5-(bromomethyl)-2-furoate, 2-furancarboxylic acid, 5-(bromomethyl)-, methyl ester, EC-000.1525, methyl 5-(bromomethyl)-furan-2-carboxylate
| Molecular Formula | C7H7BrO3 |
|---|---|
| Molecular Weight | 217.96 g/mol |
| LogP | 1.9611 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.95786 |
| Heavy Atoms | 11 |
| Complexity | 253.9433 |
Chemical Identifiers
| CAS Number | 70117-25-8 |
|---|---|
| SMILES | COC(=O)C1=CC=C(O1)CBr |
Product Overview
Methyl 5-(bromomethyl)furan-2-carboxylate (CAS 70117-25-8), with molecular formula C7H7BrO3 and molecular weight 217.96 g/mol. IUPAC: methyl 5-(bromomethyl)furan-2-carboxylate.
Chemical Property Profile of Methyl 5-(bromomethyl)furan-2-carboxylate
Property Insights of Methyl 5-(bromomethyl)furan-2-carboxylate
The XLogP value of 1.9611 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 5-(bromomethyl)furan-2-carboxylate. With a topological polar surface area (TPSA) of 39.44 Ų, Methyl 5-(bromomethyl)furan-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 5-(bromomethyl)furan-2-carboxylate has 0 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 Methyl 5-(bromomethyl)furan-2-carboxylate?
The CAS number of Methyl 5-(bromomethyl)furan-2-carboxylate is 70117-25-8.
What is the molecular formula of Methyl 5-(bromomethyl)furan-2-carboxylate?
The molecular formula of Methyl 5-(bromomethyl)furan-2-carboxylate is C7H7BrO3.
What is the molecular weight of Methyl 5-(bromomethyl)furan-2-carboxylate?
The molecular weight of Methyl 5-(bromomethyl)furan-2-carboxylate is 217.96 g/mol.
Where can I buy Methyl 5-(bromomethyl)furan-2-carboxylate?
You can request a quote for Methyl 5-(bromomethyl)furan-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-(bromomethyl)furan-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-(bromomethyl)furan-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.