2-Nitro-5-methoxybenzofuran
TL;DR: 2-Nitro-5-methoxybenzofuran (CAS 30335-72-9) is a chemical compound with molecular formula C9H7NO4 and molecular weight 193.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-nitro-1-benzofuran
Also Known As: 5-Methoxy-2-nitrobenzofuran, 2-Nitro-5-methoxybenzofuran, 5-methoxy-2-nitro-1-benzofuran, BENZOFURAN, 5-METHOXY-2-NITRO-, 5-17-04-00204 (Beilstein Handbook Reference)
| Molecular Formula | C9H7NO4 |
|---|---|
| Molecular Weight | 193.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.0375 |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 30335-72-9 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)OC(=C2)[N+](=O)[O-] |
| InChIKey | MQJDCMRJYZIXBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Nitro-5-methoxybenzofuran (CAS 30335-72-9), with molecular formula C9H7NO4 and molecular weight 193.04 g/mol. IUPAC: 5-methoxy-2-nitro-1-benzofuran.
Chemical Property Profile of 2-Nitro-5-methoxybenzofuran
Property Insights of 2-Nitro-5-methoxybenzofuran
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitro-5-methoxybenzofuran. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitro-5-methoxybenzofuran. Following Lipinski's Rule of Five, 2-Nitro-5-methoxybenzofuran 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 2-Nitro-5-methoxybenzofuran?
The CAS number of 2-Nitro-5-methoxybenzofuran is 30335-72-9.
What is the molecular formula of 2-Nitro-5-methoxybenzofuran?
The molecular formula of 2-Nitro-5-methoxybenzofuran is C9H7NO4.
What is the molecular weight of 2-Nitro-5-methoxybenzofuran?
The molecular weight of 2-Nitro-5-methoxybenzofuran is 193.04 g/mol.
Where can I buy 2-Nitro-5-methoxybenzofuran?
You can request a quote for 2-Nitro-5-methoxybenzofuran 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-methoxybenzofuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitro-5-methoxybenzofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.