1-(2-(2,4-Dichlorophenyl)-2-oxoethyl)-1H-imidazole mono(toluene-4-sulphonate)

Base Information

• Chemical Name: 1-(2-(2,4-Dichlorophenyl)-2-oxoethyl)-1H-imidazole mono(toluene-4-sulphonate)
• CAS No.: 79146-63-7
• Molecular Formula: C₇H₈O₃S*C₁₁H₈Cl₂N₂O
• Molecular Weight: 427.308
• European Community (EC) Number: 279-097-9
• DSSTox Substance ID: DTXSID20229554
• Mol file: 79146-63-7.mol

Synonyms:79146-63-7;EINECS 279-097-9;1-(2-(2,4-Dichlorophenyl)-2-oxoethyl)-1H-imidazole mono(toluene-4-sulphonate);1-[2-(2,4-DICHLOROPHENYL)-2-OXOETHYL]-1H-IMIDAZOLE MONO(TOLUENE-4-SULFONATE);SCHEMBL10505827;DTXSID20229554;NTDDQTLMDLQJOU-UHFFFAOYSA-N;NS00090327

Chemical Property of 1-(2-(2,4-Dichlorophenyl)-2-oxoethyl)-1H-imidazole mono(toluene-4-sulphonate)

Chemical Property:

• Vapor Pressure: 1.61E-18mmHg at 25°C
• Boiling Point: 663.7°Cat760mmHg
• Flash Point: 355.2°C
• PSA: 97.64000
• Density: g/cm³
• LogP: 5.39530
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 426.0207836
• Heavy Atom Count: 27
• Complexity: 469

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=C(C=C1Cl)Cl)C(=O)CN2C=CN=C2