3-Chloro-N-[4-(2-hydroxyethyl)-4-oxo-4lambda~5~-piperazine-1-sulfinyl]-5-methyl-6-oxocyclohexa-2,4-diene-1-carboximidic acid

Base Information

• Chemical Name: 3-Chloro-N-[4-(2-hydroxyethyl)-4-oxo-4lambda~5~-piperazine-1-sulfinyl]-5-methyl-6-oxocyclohexa-2,4-diene-1-carboximidic acid
• CAS No.: 54439-76-8
• Molecular Formula: C14H20ClN3O5S
• Molecular Weight: 377.8437
• DSSTox Substance ID: DTXSID50969572

Synonyms:DTXSID50969572;3-Chloro-N-[4-(2-hydroxyethyl)-4-oxo-4lambda~5~-piperazine-1-sulfinyl]-5-methyl-6-oxocyclohexa-2,4-diene-1-carboximidic acid

Chemical Property of 3-Chloro-N-[4-(2-hydroxyethyl)-4-oxo-4lambda~5~-piperazine-1-sulfinyl]-5-methyl-6-oxocyclohexa-2,4-diene-1-carboximidic acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 377.0812196
• Heavy Atom Count: 24
• Complexity: 614

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(C1=O)C(=O)NS(=O)N2CC[N+](CC2)(CCO)[O-])Cl

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