Pyrifenox-captan mixt.
TL;DR: Pyrifenox-captan mixt. (CAS 101848-68-4) is a chemical compound with molecular formula C23H20Cl5N3O3S and molecular weight 592.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-ylethanimine;2-(trichloromethylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
Also Known As: Pyrifenox-captan mixt., Pyrifenox - captan mixt., 1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-yl-ethanimine, 1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-yl-ethanimine; 2-(trichloromethylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione, 1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-ylethanimine,2-(trichloromethylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione
| Molecular Formula | C23H20Cl5N3O3S |
|---|---|
| Molecular Weight | 592.97 g/mol |
| LogP | 6.8951 |
| Topological Polar Surface Area | 97.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 592.9668 |
| Heavy Atoms | 35 |
| Complexity | 652.0 |
Chemical Identifiers
| CAS Number | 101848-68-4 |
|---|---|
| SMILES | CON=C(CC1=CN=CC=C1)C2=C(C=C(C=C2)Cl)Cl.C1C=CCC2C1C(=O)N(C2=O)SC(Cl)(Cl)Cl |
| InChIKey | YYCQCIVDPGDLEQ-UHFFFAOYSA-N |
Product Overview
Pyrifenox-captan mixt. (CAS 101848-68-4), with molecular formula C23H20Cl5N3O3S and molecular weight 592.97 g/mol. IUPAC: 1-(2,4-dichlorophenyl)-N-methoxy-2-pyridin-3-ylethanimine;2-(trichloromethylsulfanyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione.
Chemical Property Profile of Pyrifenox-captan mixt.
Property Insights of Pyrifenox-captan mixt.
The XLogP value of 6.8951 indicates that Pyrifenox-captan mixt. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrifenox-captan mixt.. Following Lipinski's Rule of Five, Pyrifenox-captan mixt. has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrifenox-captan mixt.?
The CAS number of Pyrifenox-captan mixt. is 101848-68-4.
What is the molecular formula of Pyrifenox-captan mixt.?
The molecular formula of Pyrifenox-captan mixt. is C23H20Cl5N3O3S.
What is the molecular weight of Pyrifenox-captan mixt.?
The molecular weight of Pyrifenox-captan mixt. is 592.97 g/mol.
Where can I buy Pyrifenox-captan mixt.?
You can request a quote for Pyrifenox-captan mixt. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrifenox-captan mixt.?
Yes, KEHONG BIO provides custom synthesis services for Pyrifenox-captan mixt. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.