Methyl isofenphos
TL;DR: Methyl isofenphos (CAS 101365-45-1) is a chemical compound with molecular formula C13H20NO4PS and molecular weight 317.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate
Also Known As: Methyl isofenphos, Isofenfos-methyl, Isofenphos-methyl, methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate, J1.433.725C
| Molecular Formula | C13H20NO4PS |
|---|---|
| Molecular Weight | 317.09 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 88.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 317.08505 |
| Heavy Atoms | 20 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 101365-45-1 |
|---|---|
| SMILES | CCOP(=S)(NC(C)C)OC1=CC=CC=C1C(=O)OC |
| InChIKey | FPEVHSIBUPWADM-UHFFFAOYSA-N |
Product Overview
Methyl isofenphos (CAS 101365-45-1), with molecular formula C13H20NO4PS and molecular weight 317.09 g/mol. IUPAC: methyl 2-[ethoxy-(propan-2-ylamino)phosphinothioyl]oxybenzoate.
Chemical Property Profile of Methyl isofenphos
Property Insights of Methyl isofenphos
The XLogP value of 3.3 indicates that Methyl isofenphos is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl isofenphos. Following Lipinski's Rule of Five, Methyl isofenphos 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 Methyl isofenphos?
The CAS number of Methyl isofenphos is 101365-45-1.
What is the molecular formula of Methyl isofenphos?
The molecular formula of Methyl isofenphos is C13H20NO4PS.
What is the molecular weight of Methyl isofenphos?
The molecular weight of Methyl isofenphos is 317.09 g/mol.
Where can I buy Methyl isofenphos?
You can request a quote for Methyl isofenphos directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl isofenphos?
Yes, KEHONG BIO provides custom synthesis services for Methyl isofenphos and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.