AC1Q6SXA structure

AC1Q6SXA

N-[2-[ethoxy(methyl)phosphoryl]sulfanylethyl]-N,4-dimethylaniline

Also Known As: Methylphosphonothioic acid O-ethyl S-(2-(methyl(4-methylphenyl)amino)ethyl) ester|o-ethyl s-{2-[methyl(4-methylphenyl)amino]ethyl} methylphosphonothioate|Phosphonothioic acid, methyl-, O-ethyl S-(2-(methyl(4-methylphenyl)amino)ethyl) ester|N-[2-[ethoxy(methyl)phosphoryl]sulfanylethyl]-N,4-dimethylaniline

CAS: 68090-95-9
Molecular Formula C13H22NO2PS
Molecular Weight 287.1109 g/mol
LogP 2.4
Topological Polar Surface Area 54.8 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 7
Exact Mass 287.1109
Monoisotopic Mass 287.1109
Heavy Atoms 18
Complexity 280.0

Chemical Identifiers

CAS Number 68090-95-9
SMILES CCOP(=O)(C)SCCN(C)C1=CC=C(C=C1)C
InChIKey QQBJQSFKEUGSEA-UHFFFAOYSA-N

Product Overview

AC1Q6SXA (CAS 68090-95-9), with molecular formula C13H22NO2PS and molecular weight 287.1109 g/mol. IUPAC: N-[2-[ethoxy(methyl)phosphoryl]sulfanylethyl]-N,4-dimethylaniline.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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