methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate
TL;DR: methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate (CAS 102575-14-4) is a chemical compound with molecular formula C11H12O5 and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate
Also Known As: methyl 2-methoxy-1,4-benzodioxan-2-carboxylate, methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate, methyl 2-methoxy-2,3-dihydro-1,4-benzodioxine-2-carboxylate, methyl 2-methoxy-3H-benzo[e]1,4-dioxin-2-carboxylate, A1076/0050490
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 0.9735 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 403.11633 |
Chemical Identifiers
| CAS Number | 102575-14-4 |
|---|---|
| SMILES | COC(=O)C1(COC2=CC=CC=C2O1)OC |
Product Overview
methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate (CAS 102575-14-4), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate.
Chemical Property Profile of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate
Property Insights of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate
The XLogP value of 0.9735 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate. With a topological polar surface area (TPSA) of 53.99 Ų, methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate has 0 hydrogen bond donor(s) and 5 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 3-methoxy-2H-1,4-benzodioxine-3-carboxylate?
The CAS number of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate is 102575-14-4.
What is the molecular formula of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate?
The molecular formula of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate is C11H12O5.
What is the molecular weight of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate?
The molecular weight of methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate is 224.07 g/mol.
Where can I buy methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate?
You can request a quote for methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-methoxy-2H-1,4-benzodioxine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.