[2-(2-Chloroanilino)-2-oxoethyl] 4-methylbenzoate

Base Information

• Chemical Name: [2-(2-Chloroanilino)-2-oxoethyl] 4-methylbenzoate
• CAS No.: 6908-24-3
• Molecular Formula: C₂₈H₄₈N₂O₂
• Molecular Weight: 444.701
• DSSTox Substance ID: DTXSID60364817
• Wikidata: Q82148985
• Mol file: 6908-24-3.mol

Synonyms:6908-24-3;[2-(2-chloroanilino)-2-oxoethyl] 4-methylbenzoate;ZINC01993665;Oprea1_833256;DTXSID60364817

Chemical Property of [2-(2-Chloroanilino)-2-oxoethyl] 4-methylbenzoate

Chemical Property:

• Vapor Pressure: 8.44E-11mmHg at 25°C
• Boiling Point: 517.1°C at 760 mmHg
• Flash Point: 266.6°C
• PSA: 58.89000
• Density: 1.303g/cm³
• LogP: 4.09340
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 303.0662210
• Heavy Atom Count: 21
• Complexity: 367

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2Cl

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