Dimethyl 2-fluorobenzene-1,3-dicarboxylate
TL;DR: Dimethyl 2-fluorobenzene-1,3-dicarboxylate (CAS 723334-03-0) is a chemical compound with molecular formula C10H9FO4 and molecular weight 212.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-fluorobenzene-1,3-dicarboxylate
Also Known As: dimethyl 2-fluoroisophthalate, dimethyl 2-fluorobenzene-1,3-dicarboxylate, Dimethyl 2-fluorobenzene-1,3-dioate, dimethyl-2-fluoroisophthalate, Dimethyl2-fluorobenzene-1,3-dioate
| Molecular Formula | C10H9FO4 |
|---|---|
| Molecular Weight | 212.05 g/mol |
| LogP | 1.3989 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.0485 |
| Heavy Atoms | 15 |
| Complexity | 366.1589 |
Chemical Identifiers
| CAS Number | 723334-03-0 |
|---|---|
| SMILES | COC(=O)C1=C(C(=CC=C1)C(=O)OC)F |
Product Overview
Dimethyl 2-fluorobenzene-1,3-dicarboxylate (CAS 723334-03-0), with molecular formula C10H9FO4 and molecular weight 212.05 g/mol. IUPAC: dimethyl 2-fluorobenzene-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 2-fluorobenzene-1,3-dicarboxylate
Property Insights of Dimethyl 2-fluorobenzene-1,3-dicarboxylate
The XLogP value of 1.3989 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2-fluorobenzene-1,3-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl 2-fluorobenzene-1,3-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl 2-fluorobenzene-1,3-dicarboxylate has 0 hydrogen bond donor(s) and 4 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 Dimethyl 2-fluorobenzene-1,3-dicarboxylate?
The CAS number of Dimethyl 2-fluorobenzene-1,3-dicarboxylate is 723334-03-0.
What is the molecular formula of Dimethyl 2-fluorobenzene-1,3-dicarboxylate?
The molecular formula of Dimethyl 2-fluorobenzene-1,3-dicarboxylate is C10H9FO4.
What is the molecular weight of Dimethyl 2-fluorobenzene-1,3-dicarboxylate?
The molecular weight of Dimethyl 2-fluorobenzene-1,3-dicarboxylate is 212.05 g/mol.
Where can I buy Dimethyl 2-fluorobenzene-1,3-dicarboxylate?
You can request a quote for Dimethyl 2-fluorobenzene-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2-fluorobenzene-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2-fluorobenzene-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.