1-(2-Benzofuryl)-2-nitropropene
TL;DR: 1-(2-Benzofuryl)-2-nitropropene (CAS 30455-72-2) is a chemical compound with molecular formula C11H9NO3 and molecular weight 203.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitroprop-1-enyl)-1-benzofuran
Also Known As: 1-(2-benzofuryl)-2-nitropropene, 2-(2-nitroprop-1-enyl)-1-benzofuran, Benzofuran, 2-(2-nitro-1-propen-1-yl)-
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.06 g/mol |
| LogP | 3.0703 |
| Topological Polar Surface Area | 56.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 506.51154 |
Chemical Identifiers
| CAS Number | 30455-72-2 |
|---|---|
| SMILES | CC(=CC1=CC2=CC=CC=C2O1)[N+](=O)[O-] |
Product Overview
1-(2-Benzofuryl)-2-nitropropene (CAS 30455-72-2), with molecular formula C11H9NO3 and molecular weight 203.06 g/mol. IUPAC: 2-(2-nitroprop-1-enyl)-1-benzofuran.
Chemical Property Profile of 1-(2-Benzofuryl)-2-nitropropene
Property Insights of 1-(2-Benzofuryl)-2-nitropropene
The XLogP value of 3.0703 indicates that 1-(2-Benzofuryl)-2-nitropropene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.28 Ų, 1-(2-Benzofuryl)-2-nitropropene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Benzofuryl)-2-nitropropene has 0 hydrogen bond donor(s) and 3 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-(2-Benzofuryl)-2-nitropropene?
The CAS number of 1-(2-Benzofuryl)-2-nitropropene is 30455-72-2.
What is the molecular formula of 1-(2-Benzofuryl)-2-nitropropene?
The molecular formula of 1-(2-Benzofuryl)-2-nitropropene is C11H9NO3.
What is the molecular weight of 1-(2-Benzofuryl)-2-nitropropene?
The molecular weight of 1-(2-Benzofuryl)-2-nitropropene is 203.06 g/mol.
Where can I buy 1-(2-Benzofuryl)-2-nitropropene?
You can request a quote for 1-(2-Benzofuryl)-2-nitropropene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Benzofuryl)-2-nitropropene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Benzofuryl)-2-nitropropene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.