Butamifos oxon
TL;DR: Butamifos oxon (CAS 56362-05-1) is a chemical compound with molecular formula C13H21N2O5P and molecular weight 316.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[ethoxy-(5-methyl-2-nitrophenoxy)phosphoryl]butan-2-amine
Also Known As: Butamifos oxon, Ethyl 5-methyl-2-nitrophenyl N-(butan-2-yl)phosphoramidate, (butan-2-yl)[ethoxy(5-methyl-2-nitrophenoxy)phosphoryl]amine, N-[ethoxy-(5-methyl-2-nitrophenoxy)phosphoryl]butan-2-amine, N-(sec-Butyl)amidophosphoric acid ethyl 2-nitro-5-methylphenyl ester
| Molecular Formula | C13H21N2O5P |
|---|---|
| Molecular Weight | 316.12 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 93.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.1188 |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 56362-05-1 |
|---|---|
| SMILES | CCC(C)NP(=O)(OCC)OC1=C(C=CC(=C1)C)[N+](=O)[O-] |
| InChIKey | KTBHXCBJYRPDHP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butamifos oxon (CAS 56362-05-1), with molecular formula C13H21N2O5P and molecular weight 316.12 g/mol. IUPAC: N-[ethoxy-(5-methyl-2-nitrophenoxy)phosphoryl]butan-2-amine.
Chemical Property Profile of Butamifos oxon
Property Insights of Butamifos oxon
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butamifos oxon. The TPSA of 93.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Butamifos oxon. Following Lipinski's Rule of Five, Butamifos oxon 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 Butamifos oxon?
The CAS number of Butamifos oxon is 56362-05-1.
What is the molecular formula of Butamifos oxon?
The molecular formula of Butamifos oxon is C13H21N2O5P.
What is the molecular weight of Butamifos oxon?
The molecular weight of Butamifos oxon is 316.12 g/mol.
Where can I buy Butamifos oxon?
You can request a quote for Butamifos oxon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butamifos oxon?
Yes, KEHONG BIO provides custom synthesis services for Butamifos oxon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.