2-Nitro-5-hydroxybenzofuran
TL;DR: 2-Nitro-5-hydroxybenzofuran (CAS 52767-29-0) is a chemical compound with molecular formula C8H5NO4 and molecular weight 179.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-1-benzofuran-5-ol
Also Known As: 2-Nitrobenzofuran-5-ol, 2-Nitro-5-hydroxybenzofuran, 2-nitro-1-benzofuran-5-ol, 5-Benzofuranol, 2-nitro-, 2-nitro-5-Benzofuranol
| Molecular Formula | C8H5NO4 |
|---|---|
| Molecular Weight | 179.02 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 179.02185 |
| Heavy Atoms | 13 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 52767-29-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1O)C=C(O2)[N+](=O)[O-] |
| InChIKey | QKIGVICQJLBWQQ-UHFFFAOYSA-N |
Product Overview
2-Nitro-5-hydroxybenzofuran (CAS 52767-29-0), with molecular formula C8H5NO4 and molecular weight 179.02 g/mol. IUPAC: 2-nitro-1-benzofuran-5-ol.
Chemical Property Profile of 2-Nitro-5-hydroxybenzofuran
Property Insights of 2-Nitro-5-hydroxybenzofuran
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitro-5-hydroxybenzofuran. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitro-5-hydroxybenzofuran. Following Lipinski's Rule of Five, 2-Nitro-5-hydroxybenzofuran 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 2-Nitro-5-hydroxybenzofuran?
The CAS number of 2-Nitro-5-hydroxybenzofuran is 52767-29-0.
What is the molecular formula of 2-Nitro-5-hydroxybenzofuran?
The molecular formula of 2-Nitro-5-hydroxybenzofuran is C8H5NO4.
What is the molecular weight of 2-Nitro-5-hydroxybenzofuran?
The molecular weight of 2-Nitro-5-hydroxybenzofuran is 179.02 g/mol.
Where can I buy 2-Nitro-5-hydroxybenzofuran?
You can request a quote for 2-Nitro-5-hydroxybenzofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitro-5-hydroxybenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitro-5-hydroxybenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.