2,7-Dimethoxy-1-nitronaphthalene
TL;DR: 2,7-Dimethoxy-1-nitronaphthalene (CAS 4614-14-6) is a chemical compound with molecular formula C12H11NO4 and molecular weight 233.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-dimethoxy-1-nitronaphthalene
Also Known As: 2,7-dimethoxy-1-nitronaphthalene, 2,7-dimethoxy-1-nitro-naphthalene, naphthalene, 2,7-dimethoxy-1-nitro-, InChI=1/C12H11NO4/c1-16-9-5-3-8-4-6-11(17-2)12(13(14)15)10(8)7-9/h3-7H,1-2H
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 64.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 278.0 |
Chemical Identifiers
| CAS Number | 4614-14-6 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C=CC(=C2[N+](=O)[O-])OC |
| InChIKey | AETNPRIRFXGCRX-UHFFFAOYSA-N |
Product Overview
2,7-Dimethoxy-1-nitronaphthalene (CAS 4614-14-6), with molecular formula C12H11NO4 and molecular weight 233.07 g/mol. IUPAC: 2,7-dimethoxy-1-nitronaphthalene.
Chemical Property Profile of 2,7-Dimethoxy-1-nitronaphthalene
Property Insights of 2,7-Dimethoxy-1-nitronaphthalene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,7-Dimethoxy-1-nitronaphthalene. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,7-Dimethoxy-1-nitronaphthalene. Following Lipinski's Rule of Five, 2,7-Dimethoxy-1-nitronaphthalene 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 2,7-Dimethoxy-1-nitronaphthalene?
The CAS number of 2,7-Dimethoxy-1-nitronaphthalene is 4614-14-6.
What is the molecular formula of 2,7-Dimethoxy-1-nitronaphthalene?
The molecular formula of 2,7-Dimethoxy-1-nitronaphthalene is C12H11NO4.
What is the molecular weight of 2,7-Dimethoxy-1-nitronaphthalene?
The molecular weight of 2,7-Dimethoxy-1-nitronaphthalene is 233.07 g/mol.
Where can I buy 2,7-Dimethoxy-1-nitronaphthalene?
You can request a quote for 2,7-Dimethoxy-1-nitronaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Dimethoxy-1-nitronaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Dimethoxy-1-nitronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.