2,4-Dinitromesitylene
TL;DR: 2,4-Dinitromesitylene (CAS 608-50-4) is a chemical compound with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trimethyl-2,4-dinitrobenzene
Also Known As: 2,4-Dinitromesitylene, Dinitromesitylene, Dinitromesitylen, 1,3,5-Trimethyl-2,4-dinitrobenzene, Mesitylene,4-dinitro-
| Molecular Formula | C9H10N2O4 |
|---|---|
| Molecular Weight | 210.06 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 210.06406 |
| Heavy Atoms | 15 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 608-50-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1[N+](=O)[O-])C)[N+](=O)[O-])C |
| InChIKey | OFMLQCPPVSVIDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dinitromesitylene (CAS 608-50-4), with molecular formula C9H10N2O4 and molecular weight 210.06 g/mol. IUPAC: 1,3,5-trimethyl-2,4-dinitrobenzene.
Chemical Property Profile of 2,4-Dinitromesitylene
Property Insights of 2,4-Dinitromesitylene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dinitromesitylene. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dinitromesitylene. Following Lipinski's Rule of Five, 2,4-Dinitromesitylene 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 2,4-Dinitromesitylene?
The CAS number of 2,4-Dinitromesitylene is 608-50-4.
What is the molecular formula of 2,4-Dinitromesitylene?
The molecular formula of 2,4-Dinitromesitylene is C9H10N2O4.
What is the molecular weight of 2,4-Dinitromesitylene?
The molecular weight of 2,4-Dinitromesitylene is 210.06 g/mol.
Where can I buy 2,4-Dinitromesitylene?
You can request a quote for 2,4-Dinitromesitylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dinitromesitylene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dinitromesitylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.