2-(4-Nitrobuta-1,3-dienyl)furan
TL;DR: 2-(4-Nitrobuta-1,3-dienyl)furan (CAS 20164-02-7) is a chemical compound with molecular formula C8H7NO3 and molecular weight 165.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrobuta-1,3-dienyl)furan
Also Known As: 2-(4-nitrobuta-1,3-dienyl)furan, 2-[(1E,3E)-4-nitrobuta-1,3-dienyl]furan
| Molecular Formula | C8H7NO3 |
|---|---|
| Molecular Weight | 165.04 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.04259 |
| Heavy Atoms | 12 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 20164-02-7 |
|---|---|
| SMILES | C1=COC(=C1)C=CC=C[N+](=O)[O-] |
| InChIKey | VVYPXKHTNVZRQI-UHFFFAOYSA-N |
Product Overview
2-(4-Nitrobuta-1,3-dienyl)furan (CAS 20164-02-7), with molecular formula C8H7NO3 and molecular weight 165.04 g/mol. IUPAC: 2-(4-nitrobuta-1,3-dienyl)furan.
Chemical Property Profile of 2-(4-Nitrobuta-1,3-dienyl)furan
Property Insights of 2-(4-Nitrobuta-1,3-dienyl)furan
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Nitrobuta-1,3-dienyl)furan. With a topological polar surface area (TPSA) of 59.0 Ų, 2-(4-Nitrobuta-1,3-dienyl)furan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Nitrobuta-1,3-dienyl)furan 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 2-(4-Nitrobuta-1,3-dienyl)furan?
The CAS number of 2-(4-Nitrobuta-1,3-dienyl)furan is 20164-02-7.
What is the molecular formula of 2-(4-Nitrobuta-1,3-dienyl)furan?
The molecular formula of 2-(4-Nitrobuta-1,3-dienyl)furan is C8H7NO3.
What is the molecular weight of 2-(4-Nitrobuta-1,3-dienyl)furan?
The molecular weight of 2-(4-Nitrobuta-1,3-dienyl)furan is 165.04 g/mol.
Where can I buy 2-(4-Nitrobuta-1,3-dienyl)furan?
You can request a quote for 2-(4-Nitrobuta-1,3-dienyl)furan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Nitrobuta-1,3-dienyl)furan?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitrobuta-1,3-dienyl)furan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.