Carbendazim phosphate
TL;DR: Carbendazim phosphate (CAS 52316-55-9) is a chemical compound with molecular formula C9H12N3O6P and molecular weight 289.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Carbendazim phosphate
methyl N-(1H-benzimidazol-2-yl)carbamate;phosphoric acid
Also Known As: Carbendazim phosphate, Correx, Lignasan BLP, Lignosan BLP, Caswell No. 525BB
| Molecular Formula | C9H12N3O6P |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 0.81 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.0464 |
| Heavy Atoms | 19 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 52316-55-9 |
|---|---|
| SMILES | COC(=O)NC1=NC2=CC=CC=C2N1.OP(=O)(O)O |
| InChIKey | REWXUTPFTIKUDX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbendazim phosphate (CAS 52316-55-9), with molecular formula C9H12N3O6P and molecular weight 289.05 g/mol. IUPAC: methyl N-(1H-benzimidazol-2-yl)carbamate;phosphoric acid.
Chemical Property Profile of Carbendazim phosphate
Property Insights of Carbendazim phosphate
The XLogP value of 0.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbendazim phosphate. The TPSA of 145.0 Ų indicates high polarity, suggesting Carbendazim phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Carbendazim phosphate has 5 hydrogen bond donor(s) and 7 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 Carbendazim phosphate?
The CAS number of Carbendazim phosphate is 52316-55-9.
What is the molecular formula of Carbendazim phosphate?
The molecular formula of Carbendazim phosphate is C9H12N3O6P.
What is the molecular weight of Carbendazim phosphate?
The molecular weight of Carbendazim phosphate is 289.05 g/mol.
Where can I buy Carbendazim phosphate?
You can request a quote for Carbendazim phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbendazim phosphate?
Yes, KEHONG BIO provides custom synthesis services for Carbendazim phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.