Isocarbophos
TL;DR: Isocarbophos (CAS 24353-61-5) is a chemical compound with molecular formula C11H16NO4PS and molecular weight 289.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[amino(methoxy)phosphinothioyl]oxybenzoate
Also Known As: Isocarbophos, Optunal, Isocarbofos, Caswell No. 574B, Bay 93820
| Molecular Formula | C11H16NO4PS |
|---|---|
| Molecular Weight | 289.05 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 289.05377 |
| Heavy Atoms | 18 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 24353-61-5 |
|---|---|
| SMILES | CC(C)OC(=O)C1=CC=CC=C1OP(=S)(N)OC |
| InChIKey | YFVOXLJXJBQDEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isocarbophos (CAS 24353-61-5), with molecular formula C11H16NO4PS and molecular weight 289.05 g/mol. IUPAC: propan-2-yl 2-[amino(methoxy)phosphinothioyl]oxybenzoate.
Chemical Property Profile of Isocarbophos
Property Insights of Isocarbophos
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isocarbophos. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Isocarbophos. Following Lipinski's Rule of Five, Isocarbophos has 1 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 Isocarbophos?
The CAS number of Isocarbophos is 24353-61-5.
What is the molecular formula of Isocarbophos?
The molecular formula of Isocarbophos is C11H16NO4PS.
What is the molecular weight of Isocarbophos?
The molecular weight of Isocarbophos is 289.05 g/mol.
Where can I buy Isocarbophos?
You can request a quote for Isocarbophos directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isocarbophos?
Yes, KEHONG BIO provides custom synthesis services for Isocarbophos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.