2-((2-Aminoethyl)dithio)benzoic acid

Base Information

• Chemical Name: 2-((2-Aminoethyl)dithio)benzoic acid
• CAS No.: 1204-53-1
• Molecular Formula: C9H11 N O2 S2 . Cl H
• Molecular Weight: 229.3191
• DSSTox Substance ID: DTXSID00923381
• ChEMBL ID: CHEMBL3277078
• Mol file: 1204-53-1.mol

Synonyms:2-((2-Aminoethyl)dithio)benzoic acid;1204-53-1;NSC 342011;NSC342011;2-(2-aminoethyldisulfanyl)benzoic acid;2-[(2-aminoethyl)disulfanyl]benzoic acid;CHEMBL3277078;(2-aminoethyldithio)benzoic acid;DTXSID00923381

Chemical Property of 2-((2-Aminoethyl)dithio)benzoic acid

Chemical Property:

• Vapor Pressure: 1.66E-06mmHg at 25°C
• Boiling Point: 381.6°C at 760 mmHg
• Flash Point: 184.6°C
• Density: 1.38g/cm³
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 229.02312094
• Heavy Atom Count: 14
• Complexity: 190

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)O)SSCCN

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