3-Nitro-2,6-xylidine
TL;DR: 3-Nitro-2,6-xylidine (CAS 67083-28-7) is a chemical compound with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyl-3-nitroaniline
Also Known As: 2,6-dimethyl-3-nitroaniline, 3-Nitro-2,6-xylidine, Lidocaine Impurity 38, 2,6-dimethyl-3-nitro-aniline, 2-amino-6-nitro-m-xylole
| Molecular Formula | C8H10N2O2 |
|---|---|
| Molecular Weight | 166.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.07423 |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 67083-28-7 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)[N+](=O)[O-])C)N |
| InChIKey | LDFJDBAOBVUXMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Nitro-2,6-xylidine (CAS 67083-28-7), with molecular formula C8H10N2O2 and molecular weight 166.07 g/mol. IUPAC: 2,6-dimethyl-3-nitroaniline.
Chemical Property Profile of 3-Nitro-2,6-xylidine
Property Insights of 3-Nitro-2,6-xylidine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-2,6-xylidine. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Nitro-2,6-xylidine. Following Lipinski's Rule of Five, 3-Nitro-2,6-xylidine has 1 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 3-Nitro-2,6-xylidine?
The CAS number of 3-Nitro-2,6-xylidine is 67083-28-7.
What is the molecular formula of 3-Nitro-2,6-xylidine?
The molecular formula of 3-Nitro-2,6-xylidine is C8H10N2O2.
What is the molecular weight of 3-Nitro-2,6-xylidine?
The molecular weight of 3-Nitro-2,6-xylidine is 166.07 g/mol.
Where can I buy 3-Nitro-2,6-xylidine?
You can request a quote for 3-Nitro-2,6-xylidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-2,6-xylidine?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-2,6-xylidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.