2-[(2,4-Dichlorophenyl)sulfonyl]acetonitrile

Base Information

• Chemical Name: 2-[(2,4-Dichlorophenyl)sulfonyl]acetonitrile
• CAS No.: 87475-64-7
• Molecular Formula: C8H5 Cl2 N O2 S
• Molecular Weight: 250.105
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID10371051
• Wikidata: Q82158273
• Mol file: 87475-64-7.mol

Synonyms:87475-64-7;2-[(2,4-Dichlorophenyl)sulfonyl]acetonitrile;2-(2,4-dichlorophenyl)sulfonylacetonitrile;2-((2,4-Dichlorophenyl)sulfonyl)acetonitrile;2,4-Dichlorobenzenesulphonylacetonitrile;[(2,4-dichlorophenyl)sulfonyl]acetonitrile;2-(2,4-dichlorobenzenesulfonyl)acetonitrile;Maybridge1_004896;SCHEMBL17730411;HMS555G12;DTXSID10371051;MFCD00068062;STL284687;2,4-Dichlorophenylsulfonylacetonitrile;AKOS015994418;MS-6665;2-(2,4-dichlorophenyl)sulfonylethanenitrile;2-(2,4-dichlorophenylsulfonyl)acetonitrile;CS-0322181;FT-0610784;(2,4-Dichlorobenzene-1-sulfonyl)acetonitrile;A842227;J-507565

Chemical Property of 2-[(2,4-Dichlorophenyl)sulfonyl]acetonitrile

Chemical Property:

• Vapor Pressure: 2.5E-08mmHg at 25°C
• Melting Point: 118-121°C
• Boiling Point: 451.1°C at 760 mmHg
• Flash Point: 226.6°C
• PSA: 66.31000
• Density: 1.515g/cm³
• LogP: 3.37148
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 248.9418050
• Heavy Atom Count: 14
• Complexity: 340

Purity/Quality:

99% ^*data from raw suppliers

2-[(2,4-Dichlorophenyl)sulfonyl]acetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
• Hazard Codes: Xn:Harmful
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)CC#N