5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole
TL;DR: 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole (CAS 319432-06-9) is a chemical compound with molecular formula C20H19NO6 and molecular weight 369.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole
Also Known As: 5-[bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole, 5-[Bis-(5-ethyl-furan-2-yl)-methyl]-6-nitro-benzo[1,3]dioxole, bis(5-ethyl-2-furyl)-(4,5-methylenedioxy-2-nitrophenyl)methane, 5-[BIS(5-ETHYLFURAN-2-YL)METHYL]-6-NITRO-2H-1,3-BENZODIOXOLE
| Molecular Formula | C20H19NO6 |
|---|---|
| Molecular Weight | 369.12 g/mol |
| LogP | 4.8145 |
| Topological Polar Surface Area | 87.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 369.12125 |
| Heavy Atoms | 27 |
| Complexity | 944.02594 |
Chemical Identifiers
| CAS Number | 319432-06-9 |
|---|---|
| SMILES | CCC1=CC=C(O1)C(C2=CC=C(O2)CC)C3=CC4=C(C=C3[N+](=O)[O-])OCO4 |
Product Overview
5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole (CAS 319432-06-9), with molecular formula C20H19NO6 and molecular weight 369.12 g/mol. IUPAC: 5-[bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole.
Chemical Property Profile of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole
Property Insights of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole
The XLogP value of 4.8145 indicates that 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole. Following Lipinski's Rule of Five, 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole has 0 hydrogen bond donor(s) and 6 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 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole?
The CAS number of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole is 319432-06-9.
What is the molecular formula of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole?
The molecular formula of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole is C20H19NO6.
What is the molecular weight of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole?
The molecular weight of 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole is 369.12 g/mol.
Where can I buy 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole?
You can request a quote for 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole?
Yes, KEHONG BIO provides custom synthesis services for 5-[Bis(5-ethylfuran-2-yl)methyl]-6-nitro-1,3-benzodioxole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.