Primisulfuron
TL;DR: Primisulfuron (CAS 113036-87-6) is a chemical compound with molecular formula C14H10F4N4O7S and molecular weight 454.02063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[4,6-bis(difluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid
Also Known As: Primisulfuron, Primisulfuron [ISO], 6-Chloro-7-methylpurine, M849, 2-[[4,6-bis(difluoromethoxy)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H10F4N4O7S |
| Molecular Weight | 454.02063 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 165.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.02063 Da |
| Heavy Atoms | 30 |
| Complexity | 691.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC(F)F)OC(F)F |
| InChIKey | GPGLBXMQFQQXDV-UHFFFAOYSA-N |
Chemical Property Profile of Primisulfuron
Property Insights of Primisulfuron
The XLogP value of 3.3 indicates that Primisulfuron is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 165.0 Ų indicates high polarity, suggesting Primisulfuron may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Primisulfuron has 3 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Primisulfuron?
The CAS number of Primisulfuron is 113036-87-6.
What is the molecular formula of Primisulfuron?
The molecular formula of Primisulfuron is C14H10F4N4O7S.
What is the molecular weight of Primisulfuron?
The molecular weight of Primisulfuron is 454.02063 g/mol.
Where can I buy Primisulfuron?
You can request a quote for Primisulfuron directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Primisulfuron?
Yes, CoreyChem provides custom synthesis services for Primisulfuron and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.