3-(N,N-Diisopropylcarbamothioyl)-2-chloroacrylic acid

Base Information

• Chemical Name: 3-(N,N-Diisopropylcarbamothioyl)-2-chloroacrylic acid
• CAS No.: 139265-93-3
• Molecular Formula: C10H16 Cl N O3 S
• Molecular Weight: 0
• Nikkaji Number: J440.354A
• Mol file: 139265-93-3.mol

Synonyms:3-(N,N-diisopropylcarbamothioyl)-2-chloroacrylic acid;DIPCAT-chloroacrylate

Chemical Property of 3-(N,N-Diisopropylcarbamothioyl)-2-chloroacrylic acid

Chemical Property:

• Vapor Pressure: 8.83E-06mmHg at 25°C
• Boiling Point: 348.3°Cat760mmHg
• Flash Point: 164.5°C
• PSA: 72.63000
• Density: 1.252g/cm³
• LogP: 2.63990
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 265.0539422
• Heavy Atom Count: 16
• Complexity: 294

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)N(C(C)C)C(=O)SC=C(C(=O)O)Cl
• Isomeric SMILES: CC(C)N(C(C)C)C(=O)S/C=C(/C(=O)O)\Cl

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