Benzoic acid, 2-methyl-5-(((1-methylethoxy)thioxomethyl)amino)-, ethyl ester

Base Information

• Chemical Name: Benzoic acid, 2-methyl-5-(((1-methylethoxy)thioxomethyl)amino)-, ethyl ester
• CAS No.: 135813-26-2
• Molecular Formula: C14H19NO3S
• Molecular Weight: 281.3706
• DSSTox Substance ID: DTXSID60159568
• Mol file: 135813-26-2.mol

Synonyms:135813-26-2;Benzoic acid, 2-methyl-5-(((1-methylethoxy)thioxomethyl)amino)-, ethyl ester;Benzoic acid, 2-methyl-5-[[(1-methylethoxy)thioxomethyl]amino]-, ethyl ester;DTXSID60159568;ethyl 5-(isopropoxycarbothioylamino)-2-methyl-benzoate

Chemical Property of Benzoic acid, 2-methyl-5-(((1-methylethoxy)thioxomethyl)amino)-, ethyl ester

Chemical Property:

• Vapor Pressure: 2.49E-05mmHg at 25°C
• Boiling Point: 358.8°Cat760mmHg
• Flash Point: 170.8°C
• Density: 1.168g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 281.10856464
• Heavy Atom Count: 19
• Complexity: 320

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=C(C=CC(=C1)NC(=S)OC(C)C)C

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