1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim
TL;DR: 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim (CAS 99776-17-7) is a chemical compound with molecular formula C22H36N2O7S2 and molecular weight 504.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[1-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-1,3-benzoxathiole;[(Z)-3-methylsulfanylbutan-2-ylideneamino] N-methylcarbamate
Also Known As: 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim, 2-Butanone, 3-(methylthio)-, O-(N-methylcarbamoyl)oxime, mixt. with 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-1,3-benzoxathiole
| Molecular Formula | C22H36N2O7S2 |
|---|---|
| Molecular Weight | 504.20 g/mol |
| LogP | 4.3929 |
| Topological Polar Surface Area | 96.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 504.19638 |
| Heavy Atoms | 33 |
| Complexity | 721.9848 |
Chemical Identifiers
| CAS Number | 99776-17-7 |
|---|---|
| SMILES | CCOCCOCCOC(C)OC1=CC2=C(C=C1)OCS2.CC(/C(=N\OC(=O)NC)/C)SC |
Product Overview
1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim (CAS 99776-17-7), with molecular formula C22H36N2O7S2 and molecular weight 504.20 g/mol. IUPAC: 5-[1-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-1,3-benzoxathiole;[(Z)-3-methylsulfanylbutan-2-ylideneamino] N-methylcarbamate.
Chemical Property Profile of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim
Property Insights of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim
The XLogP value of 4.3929 indicates that 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim. Following Lipinski's Rule of Five, 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim?
The CAS number of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim is 99776-17-7.
What is the molecular formula of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim?
The molecular formula of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim is C22H36N2O7S2.
What is the molecular weight of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim?
The molecular weight of 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim is 504.20 g/mol.
Where can I buy 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim?
You can request a quote for 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzoxathiole, 5-(1-(2-(2-ethoxyethoxy)ethoxy)ethoxy)-, mixt. with butocarboxim and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.