Dinoterb acetate
TL;DR: Dinoterb acetate (CAS 3204-27-1) is a chemical compound with molecular formula C12H14N2O6 and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-tert-butyl-4,6-dinitrophenyl) acetate
Also Known As: Dinoterb acetate, Dinoterbe acetate, Dinoterb acetate [ISO], DINOIL, DINOTERBACETATE
| Molecular Formula | C12H14N2O6 |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.08517 |
| Heavy Atoms | 20 |
| Complexity | 406.0 |
Chemical Identifiers
| CAS Number | 3204-27-1 |
|---|---|
| SMILES | CC(=O)OC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(C)(C)C |
| InChIKey | BMJYKXALMDAIEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dinoterb acetate (CAS 3204-27-1), with molecular formula C12H14N2O6 and molecular weight 282.09 g/mol. IUPAC: (2-tert-butyl-4,6-dinitrophenyl) acetate.
Chemical Property Profile of Dinoterb acetate
Property Insights of Dinoterb acetate
The XLogP value of 3.0 indicates that Dinoterb 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 Dinoterb acetate. Following Lipinski's Rule of Five, Dinoterb 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 Dinoterb acetate?
The CAS number of Dinoterb acetate is 3204-27-1.
What is the molecular formula of Dinoterb acetate?
The molecular formula of Dinoterb acetate is C12H14N2O6.
What is the molecular weight of Dinoterb acetate?
The molecular weight of Dinoterb acetate is 282.09 g/mol.
Where can I buy Dinoterb acetate?
You can request a quote for Dinoterb acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dinoterb acetate?
Yes, KEHONG BIO provides custom synthesis services for Dinoterb acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.