1-(Bromomethyl)-2-methyl-3-(trifluoromethyl)benzene

Base Information

• Chemical Name: 1-(Bromomethyl)-2-methyl-3-(trifluoromethyl)benzene
• CAS No.: 261952-16-3
• Molecular Formula: C9H8BrF3
• Molecular Weight: 253.062
• Hs Code.: 2903999090
• European Community (EC) Number: 679-143-1
• DSSTox Substance ID: DTXSID90379616
• Wikidata: Q72492014
• Mol file: 261952-16-3.mol

Synonyms:261952-16-3;1-(bromomethyl)-2-methyl-3-(trifluoromethyl)benzene;2-Methyl-3-(trifluoromethyl)benzyl bromide;2-METHYL-3-TRIFLUOROMETHYLBENZYL BROMIDE;Benzene, 1-(bromomethyl)-2-methyl-3-(trifluoromethyl)-;SCHEMBL724189;DTXSID90379616;BCP24586;CL8710;MFCD01631608;AKOS015919729;AM84066;AS-46082;FT-0650854;2-Methyl-3-(trifluoromethyl)benzyl bromide, AldrichCPR

Chemical Property of 1-(Bromomethyl)-2-methyl-3-(trifluoromethyl)benzene

Chemical Property:

• Vapor Pressure: 0.232mmHg at 25°C
• Refractive Index: 1.489
• Boiling Point: 214.1 °C at 760 mmHg
• Flash Point: 96.1 °C
• PSA: 0.00000
• Density: 1.499 g/cm³
• LogP: 3.90870
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 251.97615
• Heavy Atom Count: 13
• Complexity: 167

Purity/Quality:

98% ^*data from raw suppliers

2-Methyl-3-(trifluoromethyl)benzylBromide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-36/37/38-36
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC=C1C(F)(F)F)CBr