Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-
TL;DR: Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- (CAS 37714-53-7) is a chemical compound with molecular formula C13H13NO4 and molecular weight 247.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2,3-dimethyl-7-[(E)-2-nitroethenyl]-1-benzofuran
Also Known As: R 5212, 4-Methoxy-2,3-dimethyl-7-(2-nitroethenyl)benzofuran, Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-, Dimethyl-2,3 methoxy-4 (nitro-2 vinyl)-7 benzofuranne, Dimethyl-2,3 methoxy-4 (nitro-2 vinyl)-7 benzofuranne [French]
| Molecular Formula | C13H13NO4 |
|---|---|
| Molecular Weight | 247.08 g/mol |
| LogP | 3.30564 |
| Topological Polar Surface Area | 65.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.08446 |
| Heavy Atoms | 18 |
| Complexity | 639.96893 |
Chemical Identifiers
| CAS Number | 37714-53-7 |
|---|---|
| SMILES | CC1=C(OC2=C(C=CC(=C12)OC)/C=C/[N+](=O)[O-])C |
Product Overview
Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- (CAS 37714-53-7), with molecular formula C13H13NO4 and molecular weight 247.08 g/mol. IUPAC: 4-methoxy-2,3-dimethyl-7-[(E)-2-nitroethenyl]-1-benzofuran.
Chemical Property Profile of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-
Property Insights of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-
The XLogP value of 3.30564 indicates that Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.51 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-. Following Lipinski's Rule of Five, Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- 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 Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-?
The CAS number of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- is 37714-53-7.
What is the molecular formula of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-?
The molecular formula of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- is C13H13NO4.
What is the molecular weight of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-?
The molecular weight of Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- is 247.08 g/mol.
Where can I buy Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-?
You can request a quote for Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzofuran, 4-methoxy-2,3-dimethyl-7-(2-nitroethenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.