3,4-Dichloro-2-nitro-6-(trifluoromethyl)toluene

Base Information

• Chemical Name: 3,4-Dichloro-2-nitro-6-(trifluoromethyl)toluene
• CAS No.: 115571-66-9
• Molecular Formula: C8H4Cl2F3NO2
• Molecular Weight: 274.026
• Hs Code.: 2904909090
• DSSTox Substance ID: DTXSID90397330
• Nikkaji Number: J153.988D
• Wikidata: Q72467191
• Mol file: 115571-66-9.mol

Synonyms:3,4-dichloro-2-nitro-6-(trifluoromethyl)toluene;115571-66-9;1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)benzene;Benzene, 1,2-dichloro-4-methyl-3-nitro-5-(trifluoromethyl)-;C8H4Cl2F3NO2;3,4-Dichloro-6-trifluoromethyl-2-nitrotoluene;SCHEMBL2612651;DTXSID90397330;MFCD04972788;AKOS005762908;CS-W006579;DS-1140;AC-11249;AM20050300;FT-0642813;3,4-dichloro-2-nitro-6-(trifluoromethyl)-toluene;A803452;4,5-Dichloro-3-nitro-2-methylbenzotrifluoride

Chemical Property of 3,4-Dichloro-2-nitro-6-(trifluoromethyl)toluene

Chemical Property:

• Vapor Pressure: 0.0257mmHg at 25°C
• Refractive Index: 1.51
• Boiling Point: 255.8 °C at 760 mmHg
• Flash Point: 108.5 °C
• PSA: 45.82000
• Density: 1.566 g/cm³
• LogP: 4.75200
• Storage Temp.: 2-8°C
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 272.9571182
• Heavy Atom Count: 16
• Complexity: 281

Purity/Quality:

98%, ^*data from raw suppliers

1,2-Dichloro-4-methyl-3-nitro-5-(trifluoromethyl)benzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T, Xi
• Hazard Codes: T,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C(C=C1C(F)(F)F)Cl)Cl)[N+](=O)[O-]
• Uses: A multisubstituted benzene derivative, 3,4-Dichloro-2-nitro-6-(trifluoromethyl)toluene can be used in the preparation of biologically active compounds such as protein kinase inhibitors. A multisubstituted benzene derivative used in the preparation of biologically active compounds such as protein kinase inhibitors.