Dinoseb
TL;DR: Dinoseb (CAS 88-85-7) is a chemical compound with molecular formula C10H12N2O5 and molecular weight 240.07462 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-butan-2-yl-4,6-dinitrophenol
Also Known As: DINOSEB, Butaphene, Hivertox, Premerge, Caldon
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12N2O5 |
| Molecular Weight | 240.07462 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.07462 Da |
| Heavy Atoms | 17 |
| Complexity | 298.0 |
| Melting Point | 100 to 108 °F (EPA, 1998) |
| Boiling Point | 332 °C |
| Density | 1.2647 at 113 °F (EPA, 1998) - Denser than water; will sink |
| Flash Point | 60.1 to 84.9 °F for 3 commercial products (EPA, 1998) |
| Vapor Pressure | 1 mmHg at 303.98 °F (EPA, 1998) |
| Refractive Index | Index of refraction 1.5707 @ 45 °C/D |
| Solubility | 0.0052 G/100 G WATER; 48 G/100 G ETHANOL; 27 G/100 G N-HEPTANE; MISCIBLE IN ETHYL ETHER, TOLUENE, & XYLENE |
| SMILES | CCC(C)C1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])O |
| InChIKey | OWZPCEFYPSAJFR-UHFFFAOYSA-N |
Product Description
Applications: Dinoseb is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Dinoseb (CAS 88-85-7) is a agrochemical intermediate with the molecular formula C10H12N2O5 and a molecular weight of 240.07 g/mol. Key physical properties include a density of 1.2647 at 113 °F (EPA, 1998) - Denser than water; will sink g/cm³, a solubility: 0.0052 G/100 G WATER; 48 G/100 G ETHANOL; 27 G/100 G N-HEPTANE; MISCIBLE IN ETHYL ETHER, TOLUENE, & XYLENE. Synonyms include DINOSEB and Butaphene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Dinoseb
Property Insights of Dinoseb
The XLogP value of 3.6 indicates that Dinoseb is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dinoseb. Following Lipinski's Rule of Five, Dinoseb has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dinoseb?
The CAS number of Dinoseb is 88-85-7.
What is the molecular formula of Dinoseb?
The molecular formula of Dinoseb is C10H12N2O5.
What is the molecular weight of Dinoseb?
The molecular weight of Dinoseb is 240.07462 g/mol.
What are the applications of Dinoseb?
Dinoseb is used in agrochemical development, including crop protection agent synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Dinoseb?
You can request a quote for Dinoseb directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dinoseb?
Yes, CoreyChem provides custom synthesis services for Dinoseb and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.