402-43-7
Product Name:
4-Bromobenzotrifluoride
Formula:
C7H4BrF3
Synonyms:
1-Bromo-4-(trifluoromethyl)benzene;4-Bromo-α,α,α-trifluorotoluene
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colorless liquid with an aromatic odor; [Alfa Aesar MSDS] |
---|---|
Kovats Retention Index | 916.1 916.1 |
Chemical Classes | Other Classes -> Halogenated Monoaromatics |
SAFETY INFORMATION
Signal word | Warning |
---|---|
Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H226:Flammable liquids H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 225.01 g/mol |
---|---|
XLogP3 | 3.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 0 |
Exact Mass | 223.94485 g/mol |
Monoisotopic Mass | 223.94485 g/mol |
Topological Polar Surface Area | 0 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 124 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |