1,4-Benzodioxan
TL;DR: 1,4-Benzodioxan (CAS 493-09-4) is a chemical compound with molecular formula C8H8O2 and molecular weight 136.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydro-1,4-benzodioxine
Also Known As: 1,4-Benzodioxane, 1,4-BENZODIOXAN, 2,3-dihydrobenzo[b][1,4]dioxine, benzodioxan, 2,3-Dihydro-1,4-benzodioxine
| Molecular Formula | C8H8O2 |
|---|---|
| Molecular Weight | 136.05 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.05243 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 493-09-4 |
|---|---|
| SMILES | C1COC2=CC=CC=C2O1 |
| InChIKey | BNBQRQQYDMDJAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Benzodioxan (CAS 493-09-4), with molecular formula C8H8O2 and molecular weight 136.05 g/mol. IUPAC: 2,3-dihydro-1,4-benzodioxine.
Chemical Property Profile of 1,4-Benzodioxan
Property Insights of 1,4-Benzodioxan
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Benzodioxan. With a topological polar surface area (TPSA) of 18.5 Ų, 1,4-Benzodioxan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Benzodioxan 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 1,4-Benzodioxan?
The CAS number of 1,4-Benzodioxan is 493-09-4.
What is the molecular formula of 1,4-Benzodioxan?
The molecular formula of 1,4-Benzodioxan is C8H8O2.
What is the molecular weight of 1,4-Benzodioxan?
The molecular weight of 1,4-Benzodioxan is 136.05 g/mol.
Where can I buy 1,4-Benzodioxan?
You can request a quote for 1,4-Benzodioxan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Benzodioxan?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Benzodioxan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.