Furfuryl 2-chloroacetate
TL;DR: Furfuryl 2-chloroacetate (CAS 51618-39-4) is a chemical compound with molecular formula C7H7ClO3 and molecular weight 174.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-2-ylmethyl 2-chloroacetate
Also Known As: FURFURYL 2-CHLOROACETATE, 2-furylmethyl 2-chloroacetate, chloro-acetic acid furfuryl ester, furan-2-ylmethyl 2-chloroacetate, 661-202-8
| Molecular Formula | C7H7ClO3 |
|---|---|
| Molecular Weight | 174.01 g/mol |
| LogP | 1.5616 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.00838 |
| Heavy Atoms | 11 |
| Complexity | 217.59938 |
Chemical Identifiers
| CAS Number | 51618-39-4 |
|---|---|
| SMILES | C1=COC(=C1)COC(=O)CCl |
Product Overview
Furfuryl 2-chloroacetate (CAS 51618-39-4), with molecular formula C7H7ClO3 and molecular weight 174.01 g/mol. IUPAC: furan-2-ylmethyl 2-chloroacetate.
Chemical Property Profile of Furfuryl 2-chloroacetate
Property Insights of Furfuryl 2-chloroacetate
The XLogP value of 1.5616 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Furfuryl 2-chloroacetate. With a topological polar surface area (TPSA) of 39.44 Ų, Furfuryl 2-chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Furfuryl 2-chloroacetate 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 Furfuryl 2-chloroacetate?
The CAS number of Furfuryl 2-chloroacetate is 51618-39-4.
What is the molecular formula of Furfuryl 2-chloroacetate?
The molecular formula of Furfuryl 2-chloroacetate is C7H7ClO3.
What is the molecular weight of Furfuryl 2-chloroacetate?
The molecular weight of Furfuryl 2-chloroacetate is 174.01 g/mol.
Where can I buy Furfuryl 2-chloroacetate?
You can request a quote for Furfuryl 2-chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furfuryl 2-chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for Furfuryl 2-chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.