2-Methylthio-2-methylpropionaldoxime
TL;DR: 2-Methylthio-2-methylpropionaldoxime (CAS 1646-75-9) is a chemical compound with molecular formula C5H11NOS and molecular weight 133.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-2-methylsulfanylpropylidene)hydroxylamine
Also Known As: ALDICARB OXIME, 2-methylthio-2-methylpropionaldoxime, 2-Methyl-2(methylthio)-propanaloxim, 2-methyl-2-(methylsulfanyl)propanaldoxime, 2-Methyl-2-(methylthio)propanal oxime
| Molecular Formula | C5H11NOS |
|---|---|
| Molecular Weight | 133.06 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 57.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 133.05614 |
| Heavy Atoms | 8 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 1646-75-9 |
|---|---|
| SMILES | CC(C)(C=NO)SC |
| InChIKey | ZFGMCJAXIZTVJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylthio-2-methylpropionaldoxime (CAS 1646-75-9), with molecular formula C5H11NOS and molecular weight 133.06 g/mol. IUPAC: N-(2-methyl-2-methylsulfanylpropylidene)hydroxylamine.
Chemical Property Profile of 2-Methylthio-2-methylpropionaldoxime
Property Insights of 2-Methylthio-2-methylpropionaldoxime
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylthio-2-methylpropionaldoxime. With a topological polar surface area (TPSA) of 57.9 Ų, 2-Methylthio-2-methylpropionaldoxime exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylthio-2-methylpropionaldoxime has 1 hydrogen bond donor(s) and 3 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 2-Methylthio-2-methylpropionaldoxime?
The CAS number of 2-Methylthio-2-methylpropionaldoxime is 1646-75-9.
What is the molecular formula of 2-Methylthio-2-methylpropionaldoxime?
The molecular formula of 2-Methylthio-2-methylpropionaldoxime is C5H11NOS.
What is the molecular weight of 2-Methylthio-2-methylpropionaldoxime?
The molecular weight of 2-Methylthio-2-methylpropionaldoxime is 133.06 g/mol.
Where can I buy 2-Methylthio-2-methylpropionaldoxime?
You can request a quote for 2-Methylthio-2-methylpropionaldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylthio-2-methylpropionaldoxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylthio-2-methylpropionaldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.