(2-Cyclohexyl-4,6-dinitrophenyl) acetate
TL;DR: (2-Cyclohexyl-4,6-dinitrophenyl) acetate (CAS 7464-57-5) is a chemical compound with molecular formula C14H16N2O6 and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-cyclohexyl-4,6-dinitrophenyl) acetate
Also Known As: Neodene, DN-acetate, (2-cyclohexyl-4,6-dinitrophenyl) acetate, 2-cyclohexyl-4,6-dinitrophenyl acetate, J3.167.209K
| Molecular Formula | C14H16N2O6 |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.10083 |
| Heavy Atoms | 22 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 7464-57-5 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C2CCCCC2 |
| InChIKey | BCAUVGPOEXLTJD-UHFFFAOYSA-N |
Product Overview
(2-Cyclohexyl-4,6-dinitrophenyl) acetate (CAS 7464-57-5), with molecular formula C14H16N2O6 and molecular weight 308.10 g/mol. IUPAC: (2-cyclohexyl-4,6-dinitrophenyl) acetate.
Chemical Property Profile of (2-Cyclohexyl-4,6-dinitrophenyl) acetate
Property Insights of (2-Cyclohexyl-4,6-dinitrophenyl) acetate
The XLogP value of 3.9 indicates that (2-Cyclohexyl-4,6-dinitrophenyl) acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Cyclohexyl-4,6-dinitrophenyl) acetate. Following Lipinski's Rule of Five, (2-Cyclohexyl-4,6-dinitrophenyl) acetate has 0 hydrogen bond donor(s) and 6 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-Cyclohexyl-4,6-dinitrophenyl) acetate?
The CAS number of (2-Cyclohexyl-4,6-dinitrophenyl) acetate is 7464-57-5.
What is the molecular formula of (2-Cyclohexyl-4,6-dinitrophenyl) acetate?
The molecular formula of (2-Cyclohexyl-4,6-dinitrophenyl) acetate is C14H16N2O6.
What is the molecular weight of (2-Cyclohexyl-4,6-dinitrophenyl) acetate?
The molecular weight of (2-Cyclohexyl-4,6-dinitrophenyl) acetate is 308.10 g/mol.
Where can I buy (2-Cyclohexyl-4,6-dinitrophenyl) acetate?
You can request a quote for (2-Cyclohexyl-4,6-dinitrophenyl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Cyclohexyl-4,6-dinitrophenyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (2-Cyclohexyl-4,6-dinitrophenyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.