2-Methyl-5-(trifluoromethyl)benzamide

Base Information

• Chemical Name: 2-Methyl-5-(trifluoromethyl)benzamide
• CAS No.: 261951-97-7
• Molecular Formula: C₉H₈F₃NO
• Molecular Weight: 203.164
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID30379594
• Wikidata: Q82169475
• Mol file: 261951-97-7.mol

Synonyms:2-Methyl-5-(trifluoromethyl)benzamide;261951-97-7;Benzamide, 2-methyl-5-(trifluoromethyl)-;3-Carbamoyl-4-methylbenzotrifluoride;SCHEMBL5323409;DTXSID30379594;WPKYOPRYNZOLOF-UHFFFAOYSA-N;MFCD01631496;AKOS015955982;JS-4214

Chemical Property of 2-Methyl-5-(trifluoromethyl)benzamide

Chemical Property:

• Vapor Pressure: 0.0904mmHg at 25°C
• Refractive Index: 1.481
• Boiling Point: 224.6°Cat760mmHg
• PKA: 15.33±0.50(Predicted)
• Flash Point: 89.6°C
• PSA: 43.09000
• Density: 1.286g/cm³
• LogP: 2.81300
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 203.05579836
• Heavy Atom Count: 14
• Complexity: 227

Purity/Quality:

98%Min ^*data from raw suppliers

2-Methyl-5-(trifluoromethyl)benzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C(F)(F)F)C(=O)N