1-(2-Furyl)-2-nitroethanol
TL;DR: 1-(2-Furyl)-2-nitroethanol (CAS 52239-33-5) is a chemical compound with molecular formula C6H7NO4 and molecular weight 157.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-yl)-2-nitroethanol
Also Known As: 1-(2-Furyl)-2-nitroethanol, 1-(furan-2-yl)-2-nitroethanol, 1-(2-furanyl)-2-nitroethanol, 1-(furan-2-yl)-2-nitroethan-1-ol, 2-Furanmethanol, a-(nitromethyl)-
| Molecular Formula | C6H7NO4 |
|---|---|
| Molecular Weight | 157.04 g/mol |
| LogP | 0.5897 |
| Topological Polar Surface Area | 76.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.0375 |
| Heavy Atoms | 11 |
| Complexity | 230.74014 |
Chemical Identifiers
| CAS Number | 52239-33-5 |
|---|---|
| SMILES | C1=COC(=C1)C(C[N+](=O)[O-])O |
Product Overview
1-(2-Furyl)-2-nitroethanol (CAS 52239-33-5), with molecular formula C6H7NO4 and molecular weight 157.04 g/mol. IUPAC: 1-(furan-2-yl)-2-nitroethanol.
Chemical Property Profile of 1-(2-Furyl)-2-nitroethanol
Property Insights of 1-(2-Furyl)-2-nitroethanol
The XLogP value of 0.5897 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Furyl)-2-nitroethanol. The TPSA of 76.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Furyl)-2-nitroethanol. Following Lipinski's Rule of Five, 1-(2-Furyl)-2-nitroethanol has 1 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 1-(2-Furyl)-2-nitroethanol?
The CAS number of 1-(2-Furyl)-2-nitroethanol is 52239-33-5.
What is the molecular formula of 1-(2-Furyl)-2-nitroethanol?
The molecular formula of 1-(2-Furyl)-2-nitroethanol is C6H7NO4.
What is the molecular weight of 1-(2-Furyl)-2-nitroethanol?
The molecular weight of 1-(2-Furyl)-2-nitroethanol is 157.04 g/mol.
Where can I buy 1-(2-Furyl)-2-nitroethanol?
You can request a quote for 1-(2-Furyl)-2-nitroethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Furyl)-2-nitroethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Furyl)-2-nitroethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.