Bromacil-diuron mixture
TL;DR: Bromacil-diuron mixture (CAS 8071-04-3) is a chemical compound with molecular formula C18H23BrCl2N4O3 and molecular weight 492.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-3-butan-2-yl-6-methyl-1H-pyrimidine-2,4-dione;3-(3,4-dichlorophenyl)-1,1-dimethylurea
Also Known As: Bromacil-diuron mixture, Etiolate, Nebeldose, Bromacil-DCMU mixt., Bromacil-DCMU mixt
| Molecular Formula | C18H23BrCl2N4O3 |
|---|---|
| Molecular Weight | 492.03 g/mol |
| LogP | 4.66542 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 492.03305 |
| Heavy Atoms | 28 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 8071-04-3 |
|---|---|
| SMILES | CCC(C)N1C(=O)C(=C(NC1=O)C)Br.CN(C)C(=O)NC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | DXRYFLAOKKJDEB-UHFFFAOYSA-N |
Product Overview
Bromacil-diuron mixture (CAS 8071-04-3), with molecular formula C18H23BrCl2N4O3 and molecular weight 492.03 g/mol. IUPAC: 5-bromo-3-butan-2-yl-6-methyl-1H-pyrimidine-2,4-dione;3-(3,4-dichlorophenyl)-1,1-dimethylurea.
Chemical Property Profile of Bromacil-diuron mixture
Property Insights of Bromacil-diuron mixture
The XLogP value of 4.66542 indicates that Bromacil-diuron mixture is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Bromacil-diuron mixture. Following Lipinski's Rule of Five, Bromacil-diuron mixture has 2 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 Bromacil-diuron mixture?
The CAS number of Bromacil-diuron mixture is 8071-04-3.
What is the molecular formula of Bromacil-diuron mixture?
The molecular formula of Bromacil-diuron mixture is C18H23BrCl2N4O3.
What is the molecular weight of Bromacil-diuron mixture?
The molecular weight of Bromacil-diuron mixture is 492.03 g/mol.
Where can I buy Bromacil-diuron mixture?
You can request a quote for Bromacil-diuron mixture directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromacil-diuron mixture?
Yes, KEHONG BIO provides custom synthesis services for Bromacil-diuron mixture and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.