2,6-Dichloro-4-(trifluoromethyl)thiobenzamide

Base Information

• Chemical Name: 2,6-Dichloro-4-(trifluoromethyl)thiobenzamide
• CAS No.: 175205-87-5
• Molecular Formula: C8H4 Cl2 F3 N S
• Molecular Weight: 274.09
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID50371671
• Wikidata: Q82159089
• ChEMBL ID: CHEMBL1450019
• Mol file: 175205-87-5.mol

Synonyms:175205-87-5;2,6-DICHLORO-4-(TRIFLUOROMETHYL)THIOBENZAMIDE;2,6-dichloro-4-(trifluoromethyl)benzenecarbothioamide;2,6-dichloro-4-(trifluoromethyl)benzene-1-carbothioamide;Benzenecarbothioamide, 2,6-dichloro-4-(trifluoromethyl)-;Maybridge1_007894;MLS000860255;CHEMBL1450019;HMS563O18;DTXSID50371671;HMS2793B15;CCG-49712;SMR000461034;FT-0610579;2,6-Dichloro-4-(trifluoromethyl)benzothioamide;A811959;SR-01000639150-1;2,6-bis(chloranyl)-4-(trifluoromethyl)benzenecarbothioamide

Chemical Property of 2,6-Dichloro-4-(trifluoromethyl)thiobenzamide

Chemical Property:

• Vapor Pressure: 0.00197mmHg at 25°C
• Melting Point: 176 °C
• Refractive Index: 1.573
• Boiling Point: 291.3°Cat760mmHg
• PKA: 11.39±0.29(Predicted)
• Flash Point: 130°C
• PSA: 58.11000
• Density: 1.58g/cm³
• LogP: 4.34670
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 272.9393602
• Heavy Atom Count: 15
• Complexity: 247

Purity/Quality:

98%min ^*data from raw suppliers

2,6-DICHLORO-4-(TRIFLUOROMETHYL)BENZENE-1-CARBOTHIOAMIDE 95 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1Cl)C(=S)N)Cl)C(F)(F)F