Methylethyl 2-chloro-5-{[(2-methoxyethoxy)thioxomethyl]amino}benzoate

Base Information

• Chemical Name: Methylethyl 2-chloro-5-{[(2-methoxyethoxy)thioxomethyl]amino}benzoate
• CAS No.: 135812-45-2
• Molecular Formula: C14H18ClNO4S
• Molecular Weight: 331.815
• DSSTox Substance ID: DTXSID10929152
• Mol file: 135812-45-2.mol

Synonyms:135812-45-2;Methylethyl 2-chloro-5-{[(2-methoxyethoxy)thioxomethyl]amino}benzoate;Methylethyl 2-chloro-5-(((2-methoxyethoxy)thioxomethyl)amino)benzoate;SCHEMBL9199791;DTXSID10929152;isopropyl 2-chloro-5-(2-methoxyethoxycarbothioylamino)benzoate;Propan-2-yl 2-chloro-5-{[(2-methoxyethoxy)(sulfanyl)methylidene]amino}benzoate

Chemical Property of Methylethyl 2-chloro-5-{[(2-methoxyethoxy)thioxomethyl]amino}benzoate

Chemical Property:

• Vapor Pressure: 6.85E-07mmHg at 25°C
• Boiling Point: 408.7°Cat760mmHg
• Flash Point: 201°C
• PSA: 88.88000
• Density: 1.279g/cm³
• LogP: 3.33800
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 331.0645069
• Heavy Atom Count: 21
• Complexity: 354

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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